N-(4-acetamido-5-chloranyl-2-methoxy-phenyl)-4-(phenylmethyl)piperazine-1-carboxamide

Systemtic Name: N-(4-acetamido-5-chloranyl-2-methoxy-phenyl)-4-(phenylmethyl)piperazine-1-carboxamide Openeye Name: N-(4-acetamido-5-chloro-2-methoxy-phenyl)-4-benzyl-piperazine-1-carboxamide CAS Name: N-(4-acetamido-5-chloro-2-methoxyphenyl)-4-(phenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-(4-acetamido-5-chloro-2-methoxyphenyl)-4-benzylpiperazine-1-carboxamide Traditional Name: N-(4-acetamido-5-chloro-2-methoxy-phenyl)-4-benzyl-piperazine-1-carboxamide Formula: C21H25ClN4O3 MolecularWeight: 416.9012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1Cl)NC(=O)N2CCN(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1Cl)NC(=O)N2CCN(CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C21H25ClN4O3/c1-15(27)23-18-13-20(29-2)19(12-17(18)22)24-21(28)26-10-8-25(9-11-26)14-16-6-4-3-5-7-16/h3-7,12-13H,8-11,14H2,1-2H3,(H,23,27)(H,24,28)