4-[(2-nitrophenyl)amino]-N-[1-(phenylmethyl)piperidin-4-yl]butanamide

Systemtic Name: 4-[(2-nitrophenyl)amino]-N-[1-(phenylmethyl)piperidin-4-yl]butanamide Openeye Name: N-(1-benzyl-4-piperidyl)-4-(2-nitroanilino)butanamide CAS Name: 4-(2-nitroanilino)-N-[1-(phenylmethyl)-4-piperidinyl]butanamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-4-(2-nitroanilino)butanamide Traditional Name: N-(1-benzyl-4-piperidyl)-4-(2-nitroanilino)butyramide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CCCNC2=CC=CC=C2[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1NC(=O)CCCNC2=CC=CC=C2[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O3/c27-22(11-6-14-23-20-9-4-5-10-21(20)26(28)29)24-19-12-15-25(16-13-19)17-18-7-2-1-3-8-18/h1-5,7-10,19,23H,6,11-17H2,(H,24,27)