(2R)-2-[(3-nitrophenyl)amino]-1-[4-(phenylmethyl)piperidin-1-yl]propan-1-one

Systemtic Name: (2R)-2-[(3-nitrophenyl)amino]-1-[4-(phenylmethyl)piperidin-1-yl]propan-1-one Openeye Name: (2R)-1-(4-benzyl-1-piperidyl)-2-(3-nitroanilino)propan-1-one CAS Name: (2R)-2-(3-nitroanilino)-1-[4-(phenylmethyl)-1-piperidinyl]-1-propanone IUPAC Name: (2R)-1-(4-benzylpiperidin-1-yl)-2-(3-nitroanilino)propan-1-one Traditional Name: (2R)-1-(4-benzylpiperidino)-2-(3-nitroanilino)propan-1-one Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)CC2=CC=CC=C2)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)N1CCC(CC1)CC2=CC=CC=C2)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O3/c1-16(22-19-8-5-9-20(15-19)24(26)27)21(25)23-12-10-18(11-13-23)14-17-6-3-2-4-7-17/h2-9,15-16,18,22H,10-14H2,1H3/t16-/m1/s1