methyl (Z)-4-azanyl-6-(4-methylphenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-oxidanylidene-hex-4-enoate

Systemtic Name: methyl (Z)-4-azanyl-6-(4-methylphenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-oxidanylidene-hex-4-enoate Openeye Name: methyl (Z)-4-amino-2-[(4-methylpiperazin-1-yl)methyl]-6-oxo-6-(p-tolyl)hex-4-enoate CAS Name: (Z)-4-amino-6-(4-methylphenyl)-2-[(4-methyl-1-piperazinyl)methyl]-6-oxo-4-hexenoic acid methyl ester IUPAC Name: methyl (Z)-4-amino-6-(4-methylphenyl)-2-[(4-methylpiperazin-1-yl)methyl]-6-oxohex-4-enoate Traditional Name: (Z)-4-amino-6-keto-2-[(4-methylpiperazino)methyl]-6-(p-tolyl)hex-4-enoic acid methyl ester Formula: C20H29N3O3 MolecularWeight: 359.46256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C(CC(CN2CCN(CC2)C)C(=O)OC)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C(/CC(CN2CCN(CC2)C)C(=O)OC)\N

InChI

InChI=1S/C20H29N3O3/c1-15-4-6-16(7-5-15)19(24)13-18(21)12-17(20(25)26-3)14-23-10-8-22(2)9-11-23/h4-7,13,17H,8-12,14,21H2,1-3H3/b18-13-