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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC2=CC=CC=C2NC1=O)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(CC1=CC2=CC=CC=C2NC1=O)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4/c1-14(2)12-23(21(26)16-7-5-8-18(11-16)24(27)28)13-17-10-15-6-3-4-9-19(15)22-20(17)25/h3-11,14H,12-13H2,1-2H3,(H,22,25)