3-[[2-[(4R)-6,8-bis(chloranyl)-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]amino]-4-[methyl(propan-2-yl)amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[2-[(4R)-6,8-bis(chloranyl)-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]amino]-4-[methyl(propan-2-yl)amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-[2-[(4R)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]anilino]-4-[isopropyl(methyl)amino]cyclobut-3-ene-1,2-dione CAS Name: 3-[2-[(4R)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]anilino]-4-[methyl(propan-2-yl)amino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-[2-[(4R)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]anilino]-4-[methyl(propan-2-yl)amino]cyclobut-3-ene-1,2-dione Traditional Name: 3-[2-[(4R)-6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]anilino]-4-[isopropyl(methyl)amino]cyclobut-3-ene-1,2-quinone Formula: C24H25Cl2N3O2 MolecularWeight: 458.3802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)C1=C(C(=O)C1=O)NC2=CC=CC=C2C3CN(CC4=C(C=C(C=C34)Cl)Cl)C

Isomeric SMILES

CC(C)N(C)C1=C(C(=O)C1=O)NC2=CC=CC=C2[C@@H]3CN(CC4=C(C=C(C=C34)Cl)Cl)C

InChI

InChI=1S/C24H25Cl2N3O2/c1-13(2)29(4)22-21(23(30)24(22)31)27-20-8-6-5-7-15(20)17-11-28(3)12-18-16(17)9-14(25)10-19(18)26/h5-10,13,17,27H,11-12H2,1-4H3/t17-/m0/s1