4-(4-butylcyclohexyl)carbonyl-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 4-(4-butylcyclohexyl)carbonyl-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-(4-butylcyclohexanecarbonyl)-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 4-[(4-butylcyclohexyl)-oxomethyl]-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-(4-butylcyclohexanecarbonyl)-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-(4-butylcyclohexanecarbonyl)-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C27H34N2O2 MolecularWeight: 418.57106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)C

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)C

InChI

InChI=1S/C27H34N2O2/c1-3-4-8-20-12-14-22(15-13-20)27(31)29-18-25(30)28-24-16-11-19(2)17-23(24)26(29)21-9-6-5-7-10-21/h5-7,9-11,16-17,20,22,26H,3-4,8,12-15,18H2,1-2H3,(H,28,30)