4-methyl-5-[2-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 4-methyl-5-[2-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 5-[2-[(4-allyloxyphenyl)methyl-methyl-amino]acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 4-methyl-5-[2-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]-1-oxoethyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 4-methyl-5-[2-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 5-[2-[(4-allyloxybenzyl)-methyl-amino]acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CN(C)CC3=CC=C(C=C3)OCC=C

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CN(C)CC3=CC=C(C=C3)OCC=C

InChI

InChI=1S/C23H27N3O3/c1-4-13-29-19-11-9-18(10-12-19)15-25(3)16-23(28)26-17(2)14-22(27)24-20-7-5-6-8-21(20)26/h4-12,17H,1,13-16H2,2-3H3,(H,24,27)