1-(3,4-dihydro-1H-isochromen-1-yl)-N-[(4-nitrophenyl)methyl]methanamine hydrochloride

Systemtic Name: 1-(3,4-dihydro-1H-isochromen-1-yl)-N-[(4-nitrophenyl)methyl]methanamine hydrochloride Openeye Name: 1-isochroman-1-yl-N-[(4-nitrophenyl)methyl]methanamine hydrochloride CAS Name: 1-(3,4-dihydro-1H-2-benzopyran-1-yl)-N-[(4-nitrophenyl)methyl]methanamine hydrochloride IUPAC Name: 1-(3,4-dihydro-1H-isochromen-1-yl)-N-[(4-nitrophenyl)methyl]methanamine hydrochloride Traditional Name: isochroman-1-ylmethyl-(4-nitrobenzyl)amine hydrochloride Formula: C17H19ClN2O3 MolecularWeight: 334.79736

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=CC=CC=C21)CNCC3=CC=C(C=C3)[N+](=O)[O-].Cl

Isomeric SMILES

C1COC(C2=CC=CC=C21)CNCC3=CC=C(C=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C17H18N2O3.ClH/c20-19(21)15-7-5-13(6-8-15)11-18-12-17-16-4-2-1-3-14(16)9-10-22-17;/h1-8,17-18H,9-12H2;1H