[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] 8-azanylnaphthalene-1-carboxylate

Systemtic Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] 8-azanylnaphthalene-1-carboxylate Openeye Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl] 8-aminonaphthalene-1-carboxylate CAS Name: 8-amino-1-naphthalenecarboxylic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 8-aminonaphthalene-1-carboxylate Traditional Name: 8-aminonaphthalene-1-carboxylic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl] ester Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)COC(=O)C3=CC=CC4=C3C(=CC=C4)N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)COC(=O)C3=CC=CC4=C3C(=CC=C4)N

InChI

InChI=1S/C22H20N2O3/c23-19-10-4-8-16-7-3-9-18(21(16)19)22(26)27-14-20(25)24-12-11-15-5-1-2-6-17(15)13-24/h1-10H,11-14,23H2