(3S)-3,11-dimethyl-5,12-bis(oxidanylidene)-N-[(1R)-2-oxidanyl-1-phenyl-ethyl]-2-phenyl-1-oxa-4-azacyclododec-8-ene-6-carboxamide

Systemtic Name: (3S)-3,11-dimethyl-5,12-bis(oxidanylidene)-N-[(1R)-2-oxidanyl-1-phenyl-ethyl]-2-phenyl-1-oxa-4-azacyclododec-8-ene-6-carboxamide Openeye Name: (3S)-N-[(1R)-2-hydroxy-1-phenyl-ethyl]-3,11-dimethyl-5,12-dioxo-2-phenyl-1-oxa-4-azacyclododec-8-ene-6-carboxamide CAS Name: (3S)-N-[(1R)-2-hydroxy-1-phenylethyl]-3,11-dimethyl-5,12-dioxo-2-phenyl-1-oxa-4-azacyclododec-8-ene-6-carboxamide IUPAC Name: (3S)-N-[(1R)-2-hydroxy-1-phenylethyl]-3,11-dimethyl-5,12-dioxo-2-phenyl-1-oxa-4-azacyclododec-8-ene-6-carboxamide Traditional Name: (3S)-N-[(1R)-2-hydroxy-1-phenyl-ethyl]-5,12-diketo-3,11-dimethyl-2-phenyl-1-oxa-4-azacyclododec-8-ene-6-carboxamide Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC=CCC(C(=O)NC(C(OC1=O)C2=CC=CC=C2)C)C(=O)NC(CO)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1C(OC(=O)C(CC=CCC(C(=O)N1)C(=O)N[C@@H](CO)C2=CC=CC=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C27H32N2O5/c1-18-11-9-10-16-22(26(32)29-23(17-30)20-12-5-3-6-13-20)25(31)28-19(2)24(34-27(18)33)21-14-7-4-8-15-21/h3-10,12-15,18-19,22-24,30H,11,16-17H2,1-2H3,(H,28,31)(H,29,32)/t18?,19-,22?,23-,24?/m0/s1