N-(4-chloranyl-3-nitro-phenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-(4-chloro-3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C16H14ClN3O3 MolecularWeight: 331.75366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O3/c17-14-6-5-13(9-15(14)20(22)23)18-16(21)19-8-7-11-3-1-2-4-12(11)10-19/h1-6,9H,7-8,10H2,(H,18,21)