(1R)-2-(4-nitrophenyl)carbonyl-3,4-dihydro-1H-isoquinoline-1-carbonitrile

Systemtic Name: (1R)-2-(4-nitrophenyl)carbonyl-3,4-dihydro-1H-isoquinoline-1-carbonitrile Openeye Name: (1R)-2-(4-nitrobenzoyl)-3,4-dihydro-1H-isoquinoline-1-carbonitrile CAS Name: (1R)-2-[(4-nitrophenyl)-oxomethyl]-3,4-dihydro-1H-isoquinoline-1-carbonitrile IUPAC Name: (1R)-2-(4-nitrobenzoyl)-3,4-dihydro-1H-isoquinoline-1-carbonitrile Traditional Name: (1R)-2-(4-nitrobenzoyl)-3,4-dihydro-1H-isoquinoline-1-carbonitrile Formula: C17H13N3O3 MolecularWeight: 307.30342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)C#N)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN([C@H](C2=CC=CC=C21)C#N)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O3/c18-11-16-15-4-2-1-3-12(15)9-10-19(16)17(21)13-5-7-14(8-6-13)20(22)23/h1-8,16H,9-10H2/t16-/m0/s1