N-(3,3-dimethyl-4-oxidanylidene-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)-3,3-diphenyl-propanamide

Systemtic Name: N-(3,3-dimethyl-4-oxidanylidene-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)-3,3-diphenyl-propanamide Openeye Name: N-(5-allyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-3,3-diphenyl-propanamide CAS Name: N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)-3,3-diphenylpropanamide IUPAC Name: N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)-3,3-diphenylpropanamide Traditional Name: N-(5-allyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)-3,3-diphenyl-propionamide Formula: C29H30N2O3 MolecularWeight: 454.5601

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=CC(=C2)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4)N(C1=O)CC=C)C

Isomeric SMILES

CC1(COC2=C(C=CC(=C2)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4)N(C1=O)CC=C)C

InChI

InChI=1S/C29H30N2O3/c1-4-17-31-25-16-15-23(18-26(25)34-20-29(2,3)28(31)33)30-27(32)19-24(21-11-7-5-8-12-21)22-13-9-6-10-14-22/h4-16,18,24H,1,17,19-20H2,2-3H3,(H,30,32)