(2S)-2-[[4-(3-chlorophenyl)piperazin-1-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[[4-(3-chlorophenyl)piperazin-1-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-3-phenyl-propionate Formula: C20H21ClN3O3- MolecularWeight: 386.85204

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)NC(CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C20H22ClN3O3/c21-16-7-4-8-17(14-16)23-9-11-24(12-10-23)20(27)22-18(19(25)26)13-15-5-2-1-3-6-15/h1-8,14,18H,9-13H2,(H,22,27)(H,25,26)/p-1/t18-/m0/s1