[2-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]ethanoylamino] 4-chloranyl-2-methyl-benzoate

Systemtic Name: [2-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]ethanoylamino] 4-chloranyl-2-methyl-benzoate Openeye Name: [[2-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]acetyl]amino] 4-chloro-2-methyl-benzoate CAS Name: 4-chloro-2-methylbenzoic acid [[2-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]-1-oxoethyl]amino] ester IUPAC Name: [[2-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]acetyl]amino] 4-chloro-2-methylbenzoate Traditional Name: 4-chloro-2-methyl-benzoic acid [[2-[4-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)phenyl]acetyl]amino] ester Formula: C26H25ClN2O3 MolecularWeight: 448.9413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)C(=O)ONC(=O)CC2=CC=C(C=C2)C3C4=CC=CC=C4CCN3C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)C(=O)ONC(=O)CC2=CC=C(C=C2)C3C4=CC=CC=C4CCN3C

InChI

InChI=1S/C26H25ClN2O3/c1-17-15-21(27)11-12-22(17)26(31)32-28-24(30)16-18-7-9-20(10-8-18)25-23-6-4-3-5-19(23)13-14-29(25)2/h3-12,15,25H,13-14,16H2,1-2H3,(H,28,30)