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

Systemtic Name: 1-(3,4-dihydro-1H-isochromen-1-yl)-N-[(3-nitrophenyl)methyl]methanamine hydrochloride Openeye Name: 1-isochroman-1-yl-N-[(3-nitrophenyl)methyl]methanamine hydrochloride CAS Name: 1-(3,4-dihydro-1H-2-benzopyran-1-yl)-N-[(3-nitrophenyl)methyl]methanamine hydrochloride IUPAC Name: 1-(3,4-dihydro-1H-isochromen-1-yl)-N-[(3-nitrophenyl)methyl]methanamine hydrochloride Traditional Name: isochroman-1-ylmethyl-(3-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(=CC=C3)[N+](=O)[O-].Cl

Isomeric SMILES

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

InChI

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