methyl 2-[6,7-diethoxy-2-[(4-ethylphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[6,7-diethoxy-2-[(4-ethylphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[6,7-diethoxy-2-[(4-ethylphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[6,7-diethoxy-2-[(4-ethylanilino)-oxomethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6,7-diethoxy-2-[(4-ethylphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[6,7-diethoxy-2-[(4-ethylphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)N2CCC3=CC(=C(C=C3C2CC(=O)OC)OCC)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)N2CCC3=CC(=C(C=C3C2CC(=O)OC)OCC)OCC

InChI

InChI=1S/C25H32N2O5/c1-5-17-8-10-19(11-9-17)26-25(29)27-13-12-18-14-22(31-6-2)23(32-7-3)15-20(18)21(27)16-24(28)30-4/h8-11,14-15,21H,5-7,12-13,16H2,1-4H3,(H,26,29)