4-[(4-nitrophenyl)amino]-N-(2-quinolin-8-ylethyl)butanamide

Systemtic Name: 4-[(4-nitrophenyl)amino]-N-(2-quinolin-8-ylethyl)butanamide Openeye Name: 4-(4-nitroanilino)-N-[2-(8-quinolyl)ethyl]butanamide CAS Name: 4-(4-nitroanilino)-N-[2-(8-quinolinyl)ethyl]butanamide IUPAC Name: 4-(4-nitroanilino)-N-(2-quinolin-8-ylethyl)butanamide Traditional Name: 4-(4-nitroanilino)-N-[2-(8-quinolyl)ethyl]butyramide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CCNC(=O)CCCNC3=CC=C(C=C3)[N+](=O)[O-])N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)CCNC(=O)CCCNC3=CC=C(C=C3)[N+](=O)[O-])N=CC=C2

InChI

InChI=1S/C21H22N4O3/c26-20(7-3-13-22-18-8-10-19(11-9-18)25(27)28)23-15-12-17-5-1-4-16-6-2-14-24-21(16)17/h1-2,4-6,8-11,14,22H,3,7,12-13,15H2,(H,23,26)