benzoic acid; N-(diphenylmethyl)-2-(3-nitrophenyl)-2-pyrrolidin-1-yl-ethanamide

Systemtic Name: benzoic acid; N-(diphenylmethyl)-2-(3-nitrophenyl)-2-pyrrolidin-1-yl-ethanamide Openeye Name: N-benzhydryl-2-(3-nitrophenyl)-2-pyrrolidin-1-yl-acetamide; benzoic acid CAS Name: benzoic acid; N-(diphenylmethyl)-2-(3-nitrophenyl)-2-(1-pyrrolidinyl)acetamide IUPAC Name: N-benzhydryl-2-(3-nitrophenyl)-2-pyrrolidin-1-ylacetamide; benzoic acid Traditional Name: N-benzhydryl-2-(3-nitrophenyl)-2-pyrrolidino-acetamide; benzoic acid Formula: C32H31N3O5 MolecularWeight: 537.60564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(C2=CC(=CC=C2)[N+](=O)[O-])C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

C1CCN(C1)C(C2=CC(=CC=C2)[N+](=O)[O-])C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C25H25N3O3.C7H6O2/c29-25(26-23(19-10-3-1-4-11-19)20-12-5-2-6-13-20)24(27-16-7-8-17-27)21-14-9-15-22(18-21)28(30)31;8-7(9)6-4-2-1-3-5-6/h1-6,9-15,18,23-24H,7-8,16-17H2,(H,26,29);1-5H,(H,8,9)