(2R)-N-(3-chloranyl-4-cyano-phenyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]propanamide

Systemtic Name: (2R)-N-(3-chloranyl-4-cyano-phenyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]propanamide Openeye Name: (2R)-N-(3-chloro-4-cyano-phenyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]propanamide CAS Name: (2R)-N-(3-chloro-4-cyanophenyl)-2-[4-(4-methoxyphenyl)-1-piperazinyl]propanamide IUPAC Name: (2R)-N-(3-chloro-4-cyanophenyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]propanamide Traditional Name: (2R)-N-(3-chloro-4-cyano-phenyl)-2-[4-(4-methoxyphenyl)piperazino]propionamide Formula: C21H23ClN4O2 MolecularWeight: 398.88592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)C#N)Cl)N2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=C(C=C1)C#N)Cl)N2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23ClN4O2/c1-15(21(27)24-17-4-3-16(14-23)20(22)13-17)25-9-11-26(12-10-25)18-5-7-19(28-2)8-6-18/h3-8,13,15H,9-12H2,1-2H3,(H,24,27)/t15-/m1/s1