N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-3-nitro-benzamide Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(C)N2CCC3=CC=CC=C3C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(C)N2CCC3=CC=CC=C3C2)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O3/c1-14-7-8-17(11-19(14)23(25)26)20(24)21-12-15(2)22-10-9-16-5-3-4-6-18(16)13-22/h3-8,11,15H,9-10,12-13H2,1-2H3,(H,21,24)