N-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-nitro-N-propyl-benzamide

Systemtic Name: N-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-nitro-N-propyl-benzamide Openeye Name: N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-nitro-N-propyl-benzamide CAS Name: N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-nitro-N-propylbenzamide IUPAC Name: N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-nitro-N-propylbenzamide Traditional Name: N-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]-3-nitro-N-propyl-benzamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC2=C(C(=CC=C2)C)NC1=O)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC1=CC2=C(C(=CC=C2)C)NC1=O)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4/c1-3-10-23(21(26)16-8-5-9-18(12-16)24(27)28)13-17-11-15-7-4-6-14(2)19(15)22-20(17)25/h4-9,11-12H,3,10,13H2,1-2H3,(H,22,25)