N-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-nitro-N-propyl-benzamide

Systemtic Name: N-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-nitro-N-propyl-benzamide Openeye Name: N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-nitro-N-propyl-benzamide CAS Name: N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-nitro-N-propylbenzamide IUPAC Name: N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-nitro-N-propylbenzamide Traditional Name: N-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-3-nitro-N-propyl-benzamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O5/c1-3-9-23(21(26)15-5-4-6-17(11-15)24(27)28)13-16-10-14-7-8-18(29-2)12-19(14)22-20(16)25/h4-8,10-12H,3,9,13H2,1-2H3,(H,22,25)