4-[2-(4-methylpiperazin-1-yl)propylamino]-4-oxidanylidene-2-(phenylmethyl)butanoic acid

Systemtic Name: 4-[2-(4-methylpiperazin-1-yl)propylamino]-4-oxidanylidene-2-(phenylmethyl)butanoic acid Openeye Name: 2-benzyl-4-[2-(4-methylpiperazin-1-yl)propylamino]-4-oxo-butanoic acid CAS Name: 4-[2-(4-methyl-1-piperazinyl)propylamino]-4-oxo-2-(phenylmethyl)butanoic acid IUPAC Name: 2-benzyl-4-[2-(4-methylpiperazin-1-yl)propylamino]-4-oxobutanoic acid Traditional Name: 2-benzyl-4-keto-4-[2-(4-methylpiperazino)propylamino]butyric acid Formula: C19H29N3O3 MolecularWeight: 347.45186

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CC(CC1=CC=CC=C1)C(=O)O)N2CCN(CC2)C

Isomeric SMILES

CC(CNC(=O)CC(CC1=CC=CC=C1)C(=O)O)N2CCN(CC2)C

InChI

InChI=1S/C19H29N3O3/c1-15(22-10-8-21(2)9-11-22)14-20-18(23)13-17(19(24)25)12-16-6-4-3-5-7-16/h3-7,15,17H,8-14H2,1-2H3,(H,20,23)(H,24,25)