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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(C(C)C)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(C(C)C)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

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