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

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-3-nitro-benzamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[3-(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)NCCCN2CCC3=CC=CC=C3C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCCN2CCC3=CC=CC=C3C2)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O3/c1-15-7-8-17(13-19(15)23(25)26)20(24)21-10-4-11-22-12-9-16-5-2-3-6-18(16)14-22/h2-3,5-8,13H,4,9-12,14H2,1H3,(H,21,24)