N-[4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)phenyl]ethanamide

Systemtic Name: N-[4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)phenyl]ethanamide Openeye Name: N-[4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)phenyl]acetamide CAS Name: N-[4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)phenyl]acetamide IUPAC Name: N-[4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)phenyl]acetamide Traditional Name: N-[4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)phenyl]acetamide Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N2CCC3=C(C2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N2CCC3=C(C2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O3/c1-12(21)18-15-3-6-16(7-4-15)19-9-8-13-2-5-17(20(22)23)10-14(13)11-19/h2-7,10H,8-9,11H2,1H3,(H,18,21)