(phenylmethyl) N-[(5S)-5-azanyl-7-(cyclohexylamino)-6-oxidanyl-7-oxidanylidene-heptyl]carbamate

Systemtic Name: (phenylmethyl) N-[(5S)-5-azanyl-7-(cyclohexylamino)-6-oxidanyl-7-oxidanylidene-heptyl]carbamate Openeye Name: benzyl N-[(5S)-5-amino-7-(cyclohexylamino)-6-hydroxy-7-oxo-heptyl]carbamate CAS Name: N-[(5S)-5-amino-7-(cyclohexylamino)-6-hydroxy-7-oxoheptyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(5S)-5-amino-7-(cyclohexylamino)-6-hydroxy-7-oxoheptyl]carbamate Traditional Name: N-[(5S)-5-amino-7-(cyclohexylamino)-6-hydroxy-7-keto-heptyl]carbamic acid benzyl ester Formula: C21H33N3O4 MolecularWeight: 391.50442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C(CCCCNC(=O)OCC2=CC=CC=C2)N)O

Isomeric SMILES

C1CCC(CC1)NC(=O)C([C@H](CCCCNC(=O)OCC2=CC=CC=C2)N)O

InChI

InChI=1S/C21H33N3O4/c22-18(19(25)20(26)24-17-11-5-2-6-12-17)13-7-8-14-23-21(27)28-15-16-9-3-1-4-10-16/h1,3-4,9-10,17-19,25H,2,5-8,11-15,22H2,(H,23,27)(H,24,26)/t18-,19?/m0/s1