11-(1,3-benzoxazol-2-ylmethyl)-2-methyl-5,12-bis(oxidanylidene)-N-[(2R)-1-oxidanyl-3-phenyl-propan-2-yl]-1-oxa-4-azacyclododec-8-ene-6-carboxamide

Systemtic Name: 11-(1,3-benzoxazol-2-ylmethyl)-2-methyl-5,12-bis(oxidanylidene)-N-[(2R)-1-oxidanyl-3-phenyl-propan-2-yl]-1-oxa-4-azacyclododec-8-ene-6-carboxamide Openeye Name: 11-(1,3-benzoxazol-2-ylmethyl)-N-[(1R)-1-benzyl-2-hydroxy-ethyl]-2-methyl-5,12-dioxo-1-oxa-4-azacyclododec-8-ene-6-carboxamide CAS Name: 11-(1,3-benzoxazol-2-ylmethyl)-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-2-methyl-5,12-dioxo-1-oxa-4-azacyclododec-8-ene-6-carboxamide IUPAC Name: 11-(1,3-benzoxazol-2-ylmethyl)-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-2-methyl-5,12-dioxo-1-oxa-4-azacyclododec-8-ene-6-carboxamide Traditional Name: 11-(1,3-benzoxazol-2-ylmethyl)-N-[(1R)-1-benzyl-2-hydroxy-ethyl]-5,12-diketo-2-methyl-1-oxa-4-azacyclododec-8-ene-6-carboxamide Formula: C29H33N3O6 MolecularWeight: 519.58882

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNC(=O)C(CC=CCC(C(=O)O1)CC2=NC3=CC=CC=C3O2)C(=O)NC(CC4=CC=CC=C4)CO

Isomeric SMILES

CC1CNC(=O)C(CC=CCC(C(=O)O1)CC2=NC3=CC=CC=C3O2)C(=O)N[C@H](CC4=CC=CC=C4)CO

InChI

InChI=1S/C29H33N3O6/c1-19-17-30-27(34)23(28(35)31-22(18-33)15-20-9-3-2-4-10-20)12-6-5-11-21(29(36)37-19)16-26-32-24-13-7-8-14-25(24)38-26/h2-10,13-14,19,21-23,33H,11-12,15-18H2,1H3,(H,30,34)(H,31,35)/t19?,21?,22-,23?/m1/s1