(2E,7R,10S,13S)-13-cyclopropyl-11-methyl-10-(2-oxidanylpropan-2-yl)-7-(phenylmethyl)-17-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),2,18,20-tetraene-6,9,12-trione

Systemtic Name: (2E,7R,10S,13S)-13-cyclopropyl-11-methyl-10-(2-oxidanylpropan-2-yl)-7-(phenylmethyl)-17-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),2,18,20-tetraene-6,9,12-trione Openeye Name: (2E,7R,10S,13S)-7-benzyl-13-cyclopropyl-10-(1-hydroxy-1-methyl-ethyl)-11-methyl-17-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),2,18,20-tetraene-6,9,12-trione CAS Name: (2E,7R,10S,13S)-13-cyclopropyl-10-(2-hydroxypropan-2-yl)-11-methyl-7-(phenylmethyl)-17-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),2,18,20-tetraene-6,9,12-trione IUPAC Name: (2E,7R,10S,13S)-7-benzyl-13-cyclopropyl-10-(2-hydroxypropan-2-yl)-11-methyl-17-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),2,18,20-tetraene-6,9,12-trione Traditional Name: (2E,7R,10S,13S)-7-benzyl-13-cyclopropyl-10-(1-hydroxy-1-methyl-ethyl)-11-methyl-17-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),2,18,20-tetraene-6,9,12-trione Formula: C31H40N4O5 MolecularWeight: 548.6731

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1C(=O)NC(C(=O)NCC=CC2=CC=CC=C2OCCNC(C(=O)N1C)C3CC3)CC4=CC=CC=C4)O

Isomeric SMILES

CC(C)([C@H]1C(=O)N[C@@H](C(=O)NC/C=C/C2=CC=CC=C2OCCN[C@H](C(=O)N1C)C3CC3)CC4=CC=CC=C4)O

InChI

InChI=1S/C31H40N4O5/c1-31(2,39)27-29(37)34-24(20-21-10-5-4-6-11-21)28(36)33-17-9-13-22-12-7-8-14-25(22)40-19-18-32-26(23-15-16-23)30(38)35(27)3/h4-14,23-24,26-27,32,39H,15-20H2,1-3H3,(H,33,36)(H,34,37)/b13-9+/t24-,26+,27-/m1/s1