5-azanyl-2-[4-azanylbutanoyl(propyl)amino]-N-(4-nitrophenyl)pentanamide

Systemtic Name: 5-azanyl-2-[4-azanylbutanoyl(propyl)amino]-N-(4-nitrophenyl)pentanamide Openeye Name: 5-amino-2-[4-aminobutanoyl(propyl)amino]-N-(4-nitrophenyl)pentanamide CAS Name: 5-amino-2-[(4-amino-1-oxobutyl)-propylamino]-N-(4-nitrophenyl)pentanamide IUPAC Name: 5-amino-2-[4-aminobutanoyl(propyl)amino]-N-(4-nitrophenyl)pentanamide Traditional Name: 5-amino-2-[4-aminobutanoyl(propyl)amino]-N-(4-nitrophenyl)valeramide Formula: C18H29N5O4 MolecularWeight: 379.45396

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(CCCN)C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])C(=O)CCCN

Isomeric SMILES

CCCN(C(CCCN)C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])C(=O)CCCN

InChI

InChI=1S/C18H29N5O4/c1-2-13-22(17(24)6-4-12-20)16(5-3-11-19)18(25)21-14-7-9-15(10-8-14)23(26)27/h7-10,16H,2-6,11-13,19-20H2,1H3,(H,21,25)