methyl 2-(4-methyl-3-oxidanylidene-7-piperazin-1-ylcarbonyl-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)ethanoate

Systemtic Name: methyl 2-(4-methyl-3-oxidanylidene-7-piperazin-1-ylcarbonyl-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)ethanoate Openeye Name: methyl 2-[4-methyl-3-oxo-7-(piperazine-1-carbonyl)-2,5-dihydro-1H-1,4-benzodiazepin-2-yl]acetate CAS Name: 2-[4-methyl-3-oxo-7-[oxo(1-piperazinyl)methyl]-2,5-dihydro-1H-1,4-benzodiazepin-2-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-methyl-3-oxo-7-(piperazine-1-carbonyl)-2,5-dihydro-1H-1,4-benzodiazepin-2-yl]acetate Traditional Name: 2-[3-keto-4-methyl-7-(piperazine-1-carbonyl)-2,5-dihydro-1H-1,4-benzodiazepin-2-yl]acetic acid methyl ester Formula: C18H24N4O4 MolecularWeight: 360.40756

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C=CC(=C2)C(=O)N3CCNCC3)NC(C1=O)CC(=O)OC

Isomeric SMILES

CN1CC2=C(C=CC(=C2)C(=O)N3CCNCC3)NC(C1=O)CC(=O)OC

InChI

InChI=1S/C18H24N4O4/c1-21-11-13-9-12(17(24)22-7-5-19-6-8-22)3-4-14(13)20-15(18(21)25)10-16(23)26-2/h3-4,9,15,19-20H,5-8,10-11H2,1-2H3