(11S)-11-[(4-nitrophenyl)methyl]-3-(phenylmethyl)-1-oxa-4-azacyclododec-8-ene-5,12-dione

Systemtic Name: (11S)-11-[(4-nitrophenyl)methyl]-3-(phenylmethyl)-1-oxa-4-azacyclododec-8-ene-5,12-dione Openeye Name: (11S)-3-benzyl-11-[(4-nitrophenyl)methyl]-1-oxa-4-azacyclododec-8-ene-5,12-dione CAS Name: (11S)-11-[(4-nitrophenyl)methyl]-3-(phenylmethyl)-1-oxa-4-azacyclododec-8-ene-5,12-dione IUPAC Name: (11S)-3-benzyl-11-[(4-nitrophenyl)methyl]-1-oxa-4-azacyclododec-8-ene-5,12-dione Traditional Name: (11S)-3-benzyl-11-(4-nitrobenzyl)-1-oxa-4-azacyclododec-8-ene-5,12-quinone Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC(COC(=O)C(CC=C1)CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)NC(COC(=O)[C@@H](CC=C1)CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C24H26N2O5/c27-23-10-6-2-5-9-20(15-19-11-13-22(14-12-19)26(29)30)24(28)31-17-21(25-23)16-18-7-3-1-4-8-18/h1-5,7-8,11-14,20-21H,6,9-10,15-17H2,(H,25,27)/t20-,21?/m0/s1