2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(4-nitrophenyl)methyl]ethanamine

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(4-nitrophenyl)methyl]ethanamine Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(4-nitrophenyl)methyl]ethanamine CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(4-nitrophenyl)methyl]ethanamine IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(4-nitrophenyl)methyl]ethanamine Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl-(4-nitrobenzyl)amine Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCNCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCNCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O2/c22-21(23)18-7-5-15(6-8-18)13-19-10-12-20-11-9-16-3-1-2-4-17(16)14-20/h1-8,19H,9-14H2