methyl (5Z)-3-oxidanylidene-5-phenyl-1-(phenylmethyl)-4-prop-2-enyl-7,8-dihydro-2H-1,4-diazocine-7-carboxylate

Systemtic Name: methyl (5Z)-3-oxidanylidene-5-phenyl-1-(phenylmethyl)-4-prop-2-enyl-7,8-dihydro-2H-1,4-diazocine-7-carboxylate Openeye Name: methyl (5Z)-4-allyl-1-benzyl-3-oxo-5-phenyl-7,8-dihydro-2H-1,4-diazocine-7-carboxylate CAS Name: (5Z)-3-oxo-5-phenyl-1-(phenylmethyl)-4-prop-2-enyl-7,8-dihydro-2H-1,4-diazocine-7-carboxylic acid methyl ester IUPAC Name: methyl (5Z)-1-benzyl-3-oxo-5-phenyl-4-prop-2-enyl-7,8-dihydro-2H-1,4-diazocine-7-carboxylate Traditional Name: (5Z)-4-allyl-1-benzyl-3-keto-5-phenyl-7,8-dihydro-2H-1,4-diazocine-7-carboxylic acid methyl ester Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CC(=O)N(C(=C1)C2=CC=CC=C2)CC=C)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C/1CN(CC(=O)N(/C(=C1)/C2=CC=CC=C2)CC=C)CC3=CC=CC=C3

InChI

InChI=1S/C24H26N2O3/c1-3-14-26-22(20-12-8-5-9-13-20)15-21(24(28)29-2)17-25(18-23(26)27)16-19-10-6-4-7-11-19/h3-13,15,21H,1,14,16-18H2,2H3/b22-15-