methyl 3-[2-[1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]ethanoylamino]-5-chloranyl-1H-indole-2-carboxylate; propan-2-ol

Systemtic Name: methyl 3-[2-[1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]ethanoylamino]-5-chloranyl-1H-indole-2-carboxylate; propan-2-ol Openeye Name: methyl 5-chloro-3-[[2-[1-[(1,3-dioxoisoindolin-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]acetyl]amino]-1H-indole-2-carboxylate; propan-2-ol CAS Name: 5-chloro-3-[[2-[1-[(1,3-dioxo-2-isoindolyl)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1-oxoethyl]amino]-1H-indole-2-carboxylic acid methyl ester; 2-propanol IUPAC Name: methyl 5-chloro-3-[[2-[1-[(1,3-dioxoisoindol-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]acetyl]amino]-1H-indole-2-carboxylate; propan-2-ol Traditional Name: 5-chloro-3-[[2-[1-(phthalimidomethyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetyl]amino]-1H-indole-2-carboxylic acid methyl ester; propan-2-ol Formula: C33H33ClN4O6 MolecularWeight: 617.09132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)O.COC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)NC(=O)CN3CCC4=CC=CC=C4C3CN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

CC(C)O.COC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)NC(=O)CN3CCC4=CC=CC=C4C3CN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C30H25ClN4O5.C3H8O/c1-40-30(39)27-26(22-14-18(31)10-11-23(22)32-27)33-25(36)16-34-13-12-17-6-2-3-7-19(17)24(34)15-35-28(37)20-8-4-5-9-21(20)29(35)38;1-3(2)4/h2-11,14,24,32H,12-13,15-16H2,1H3,(H,33,36);3-4H,1-2H3