N'-(1-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl)-3-(2-methylpropyl)-2-prop-2-enyl-butanediamide

Systemtic Name: N'-(1-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl)-3-(2-methylpropyl)-2-prop-2-enyl-butanediamide Openeye Name: 2-allyl-3-isobutyl-N'-(1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl)butanediamide CAS Name: N'-(1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl)-3-(2-methylpropyl)-2-prop-2-enylbutanediamide IUPAC Name: N'-(1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl)-3-(2-methylpropyl)-2-prop-2-enylbutanediamide Traditional Name: 2-allyl-3-isobutyl-N'-(2-keto-1-methyl-4,5-dihydro-3H-1-benzazepin-3-yl)succinamide Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CC=C)C(=O)N)C(=O)NC1CCC2=CC=CC=C2N(C1=O)C

Isomeric SMILES

CC(C)CC(C(CC=C)C(=O)N)C(=O)NC1CCC2=CC=CC=C2N(C1=O)C

InChI

InChI=1S/C22H31N3O3/c1-5-8-16(20(23)26)17(13-14(2)3)21(27)24-18-12-11-15-9-6-7-10-19(15)25(4)22(18)28/h5-7,9-10,14,16-18H,1,8,11-13H2,2-4H3,(H2,23,26)(H,24,27)