N-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-N-propyl-benzamide

Systemtic Name: N-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-N-propyl-benzamide Openeye Name: N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-4-nitro-N-propyl-benzamide CAS Name: N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-4-nitro-N-propylbenzamide IUPAC Name: N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-4-nitro-N-propylbenzamide Traditional Name: N-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-4-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=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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