[4-[2-azanyl-3-(2,3-dihydroindol-1-yl)-3-oxidanylidene-propyl]-3-bromanyl-5-methyl-phenyl] methyl carbonate

Systemtic Name: [4-[2-azanyl-3-(2,3-dihydroindol-1-yl)-3-oxidanylidene-propyl]-3-bromanyl-5-methyl-phenyl] methyl carbonate Openeye Name: [4-(2-amino-3-indolin-1-yl-3-oxo-propyl)-3-bromo-5-methyl-phenyl] methyl carbonate CAS Name: carbonic acid [4-[2-amino-3-(2,3-dihydroindol-1-yl)-3-oxopropyl]-3-bromo-5-methylphenyl] methyl ester IUPAC Name: [4-[2-amino-3-(2,3-dihydroindol-1-yl)-3-oxopropyl]-3-bromo-5-methylphenyl] methyl carbonate Traditional Name: carbonic acid [4-(2-amino-3-indolin-1-yl-3-keto-propyl)-3-bromo-5-methyl-phenyl] methyl ester Formula: C20H21BrN2O4 MolecularWeight: 433.29574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC(C(=O)N2CCC3=CC=CC=C32)N)Br)OC(=O)OC

Isomeric SMILES

CC1=CC(=CC(=C1CC(C(=O)N2CCC3=CC=CC=C32)N)Br)OC(=O)OC

InChI

InChI=1S/C20H21BrN2O4/c1-12-9-14(27-20(25)26-2)10-16(21)15(12)11-17(22)19(24)23-8-7-13-5-3-4-6-18(13)23/h3-6,9-10,17H,7-8,11,22H2,1-2H3