4-[(4-nitrophenyl)amino]-N-[1-(phenylmethyl)pyrrolidin-3-yl]butanamide

Systemtic Name: 4-[(4-nitrophenyl)amino]-N-[1-(phenylmethyl)pyrrolidin-3-yl]butanamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-4-(4-nitroanilino)butanamide CAS Name: 4-(4-nitroanilino)-N-[1-(phenylmethyl)-3-pyrrolidinyl]butanamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-4-(4-nitroanilino)butanamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-4-(4-nitroanilino)butyramide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC1NC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O3/c26-21(7-4-13-22-18-8-10-20(11-9-18)25(27)28)23-19-12-14-24(16-19)15-17-5-2-1-3-6-17/h1-3,5-6,8-11,19,22H,4,7,12-16H2,(H,23,26)