(E)-N-(1,2-dihydroacenaphthylen-5-ylmethyl)-N-methyl-3-(4-methyl-2-oxidanylidene-3,5-dihydro-1H-1,4-benzodiazepin-7-yl)prop-2-enamide

Systemtic Name: (E)-N-(1,2-dihydroacenaphthylen-5-ylmethyl)-N-methyl-3-(4-methyl-2-oxidanylidene-3,5-dihydro-1H-1,4-benzodiazepin-7-yl)prop-2-enamide Openeye Name: (E)-N-(1,2-dihydroacenaphthylen-5-ylmethyl)-N-methyl-3-(4-methyl-2-oxo-3,5-dihydro-1H-1,4-benzodiazepin-7-yl)prop-2-enamide CAS Name: (E)-N-(1,2-dihydroacenaphthylen-5-ylmethyl)-N-methyl-3-(4-methyl-2-oxo-3,5-dihydro-1H-1,4-benzodiazepin-7-yl)-2-propenamide IUPAC Name: (E)-N-(1,2-dihydroacenaphthylen-5-ylmethyl)-N-methyl-3-(4-methyl-2-oxo-3,5-dihydro-1H-1,4-benzodiazepin-7-yl)prop-2-enamide Traditional Name: (E)-N-(acenaphthen-5-ylmethyl)-3-(2-keto-4-methyl-3,5-dihydro-1H-1,4-benzodiazepin-7-yl)-N-methyl-acrylamide Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C=CC(=C2)C=CC(=O)N(C)CC3=C4C=CC=C5C4=C(CC5)C=C3)NC(=O)C1

Isomeric SMILES

CN1CC2=C(C=CC(=C2)/C=C/C(=O)N(C)CC3=C4C=CC=C5C4=C(CC5)C=C3)NC(=O)C1

InChI

InChI=1S/C27H27N3O2/c1-29-15-22-14-18(6-12-24(22)28-25(31)17-29)7-13-26(32)30(2)16-21-11-10-20-9-8-19-4-3-5-23(21)27(19)20/h3-7,10-14H,8-9,15-17H2,1-2H3,(H,28,31)/b13-7+