N-(4-azanylbutanoyl)-N-[6-azanyl-1-[(4-nitrophenyl)amino]-1-oxidanylidene-hexan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylbutanoyl)-N-[6-azanyl-1-[(4-nitrophenyl)amino]-1-oxidanylidene-hexan-2-yl]pyrrolidine-2-carboxamide Openeye Name: N-(4-aminobutanoyl)-N-[5-amino-1-[(4-nitrophenyl)carbamoyl]pentyl]pyrrolidine-2-carboxamide CAS Name: N-[6-amino-1-(4-nitroanilino)-1-oxohexan-2-yl]-N-(4-amino-1-oxobutyl)-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminobutanoyl)-N-[6-amino-1-(4-nitroanilino)-1-oxohexan-2-yl]pyrrolidine-2-carboxamide Traditional Name: N-(4-aminobutanoyl)-N-[5-amino-1-[(4-nitrophenyl)carbamoyl]pentyl]pyrrolidine-2-carboxamide Formula: C21H32N6O5 MolecularWeight: 448.51598

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)N(C(CCCCN)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCCN

Isomeric SMILES

C1CC(NC1)C(=O)N(C(CCCCN)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCCN

InChI

InChI=1S/C21H32N6O5/c22-12-2-1-6-18(20(29)25-15-8-10-16(11-9-15)27(31)32)26(19(28)7-3-13-23)21(30)17-5-4-14-24-17/h8-11,17-18,24H,1-7,12-14,22-23H2,(H,25,29)