(2R,8E)-4-[[4-(hydroxymethyl)phenyl]methyl]-2-phenyl-1-oxa-4-azacyclododec-8-ene-5,12-dione

Systemtic Name: (2R,8E)-4-[[4-(hydroxymethyl)phenyl]methyl]-2-phenyl-1-oxa-4-azacyclododec-8-ene-5,12-dione Openeye Name: (2R,8E)-4-[[4-(hydroxymethyl)phenyl]methyl]-2-phenyl-1-oxa-4-azacyclododec-8-ene-5,12-dione CAS Name: (2R,8E)-4-[[4-(hydroxymethyl)phenyl]methyl]-2-phenyl-1-oxa-4-azacyclododec-8-ene-5,12-dione IUPAC Name: (2R,8E)-4-[[4-(hydroxymethyl)phenyl]methyl]-2-phenyl-1-oxa-4-azacyclododec-8-ene-5,12-dione Traditional Name: (2R,8E)-4-(4-methylolbenzyl)-2-phenyl-1-oxa-4-azacyclododec-8-ene-5,12-quinone Formula: C24H27NO4 MolecularWeight: 393.47548

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC(OC(=O)CCC=C1)C2=CC=CC=C2)CC3=CC=C(C=C3)CO

Isomeric SMILES

C\1CC(=O)N(C[C@H](OC(=O)CC/C=C1)C2=CC=CC=C2)CC3=CC=C(C=C3)CO

InChI

InChI=1S/C24H27NO4/c26-18-20-14-12-19(13-15-20)16-25-17-22(21-8-4-3-5-9-21)29-24(28)11-7-2-1-6-10-23(25)27/h1-5,8-9,12-15,22,26H,6-7,10-11,16-18H2/b2-1+/t22-/m0/s1