propan-2-yl 3-nitro-4-[(3-piperidin-1-ylphenyl)amino]benzoate

Systemtic Name: propan-2-yl 3-nitro-4-[(3-piperidin-1-ylphenyl)amino]benzoate Openeye Name: isopropyl 3-nitro-4-[3-(1-piperidyl)anilino]benzoate CAS Name: 3-nitro-4-[3-(1-piperidinyl)anilino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-nitro-4-(3-piperidin-1-ylanilino)benzoate Traditional Name: 3-nitro-4-(3-piperidinoanilino)benzoic acid isopropyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O4/c1-15(2)28-21(25)16-9-10-19(20(13-16)24(26)27)22-17-7-6-8-18(14-17)23-11-4-3-5-12-23/h6-10,13-15,22H,3-5,11-12H2,1-2H3