4-nitro-N-(5,6,7,8-tetrahydroisoquinolin-1-yl)benzamide

Systemtic Name: 4-nitro-N-(5,6,7,8-tetrahydroisoquinolin-1-yl)benzamide Openeye Name: 4-nitro-N-(5,6,7,8-tetrahydroisoquinolin-1-yl)benzamide CAS Name: 4-nitro-N-(5,6,7,8-tetrahydroisoquinolin-1-yl)benzamide IUPAC Name: 4-nitro-N-(5,6,7,8-tetrahydroisoquinolin-1-yl)benzamide Traditional Name: 4-nitro-N-(5,6,7,8-tetrahydroisoquinolin-1-yl)benzamide Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CN=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C=CN=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O3/c20-16(12-5-7-13(8-6-12)19(21)22)18-15-14-4-2-1-3-11(14)9-10-17-15/h5-10H,1-4H2,(H,17,18,20)