2-[(2-aminophenyl)amino]-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-butan-1-one

Systemtic Name: 2-[(2-aminophenyl)amino]-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-butan-1-one Openeye Name: 2-(2-aminoanilino)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-butan-1-one CAS Name: 2-(2-aminoanilino)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-1-butanone IUPAC Name: 2-(2-aminoanilino)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethylbutan-1-one Traditional Name: 2-(2-aminoanilino)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-butan-1-one Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CCC2=CC(=C(C=C2C1)OC)OC)NC3=CC=CC=C3N

Isomeric SMILES

CC(C)(C)C(C(=O)N1CCC2=CC(=C(C=C2C1)OC)OC)NC3=CC=CC=C3N

InChI

InChI=1S/C23H31N3O3/c1-23(2,3)21(25-18-9-7-6-8-17(18)24)22(27)26-11-10-15-12-19(28-4)20(29-5)13-16(15)14-26/h6-9,12-13,21,25H,10-11,14,24H2,1-5H3