3-(2-methylpropyl)-N'-(6-oxidanylidene-5-phenethyl-7H-benzo[d][1]benzazepin-7-yl)-2-prop-2-enyl-butanediamide

Systemtic Name: 3-(2-methylpropyl)-N'-(6-oxidanylidene-5-phenethyl-7H-benzo[d][1]benzazepin-7-yl)-2-prop-2-enyl-butanediamide Openeye Name: 2-allyl-3-isobutyl-N'-(6-oxo-5-phenethyl-7H-benzo[d][1]benzazepin-7-yl)butanediamide CAS Name: 3-(2-methylpropyl)-N'-(6-oxo-5-phenethyl-7H-benzo[d][1]benzazepin-7-yl)-2-prop-2-enylbutanediamide IUPAC Name: 3-(2-methylpropyl)-N'-(6-oxo-5-phenethyl-7H-benzo[d][1]benzazepin-7-yl)-2-prop-2-enylbutanediamide Traditional Name: 2-allyl-3-isobutyl-N'-(6-keto-5-phenethyl-7H-benzo[d][1]benzazepin-7-yl)succinamide Formula: C33H37N3O3 MolecularWeight: 523.66518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CC=C)C(=O)N)C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)CC(C(CC=C)C(=O)N)C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)CCC4=CC=CC=C4

InChI

InChI=1S/C33H37N3O3/c1-4-12-27(31(34)37)28(21-22(2)3)32(38)35-30-26-17-9-8-15-24(26)25-16-10-11-18-29(25)36(33(30)39)20-19-23-13-6-5-7-14-23/h4-11,13-18,22,27-28,30H,1,12,19-21H2,2-3H3,(H2,34,37)(H,35,38)