1-[4-[(4-nitrophenyl)amino]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile hydrochloride

Systemtic Name: 1-[4-[(4-nitrophenyl)amino]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile hydrochloride Openeye Name: 1-[4-(4-nitroanilino)pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile hydrochloride CAS Name: 1-[[4-(4-nitroanilino)-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarbonitrile hydrochloride IUPAC Name: 1-[4-(4-nitroanilino)pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile hydrochloride Traditional Name: 1-[4-(4-nitroanilino)prolyl]pyrrolidine-2-carbonitrile hydrochloride Formula: C16H20ClN5O3 MolecularWeight: 365.8147

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CC(CN2)NC3=CC=C(C=C3)[N+](=O)[O-])C#N.Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C2CC(CN2)NC3=CC=C(C=C3)[N+](=O)[O-])C#N.Cl

InChI

InChI=1S/C16H19N5O3.ClH/c17-9-14-2-1-7-20(14)16(22)15-8-12(10-18-15)19-11-3-5-13(6-4-11)21(23)24;/h3-6,12,14-15,18-19H,1-2,7-8,10H2;1H