methyl 1-[2-[(5-bromanyl-2-morpholin-4-yl-phenyl)amino]-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[(5-bromanyl-2-morpholin-4-yl-phenyl)amino]-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-(5-bromo-2-morpholino-anilino)-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-[5-bromo-2-(4-morpholinyl)anilino]-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(5-bromo-2-morpholin-4-ylanilino)-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-(5-bromo-2-morpholino-anilino)-2-keto-ethyl]indole-3-carboxylic acid methyl ester Formula: C22H22BrN3O4 MolecularWeight: 472.33178

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NC3=C(C=CC(=C3)Br)N4CCOCC4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NC3=C(C=CC(=C3)Br)N4CCOCC4

InChI

InChI=1S/C22H22BrN3O4/c1-29-22(28)17-13-26(19-5-3-2-4-16(17)19)14-21(27)24-18-12-15(23)6-7-20(18)25-8-10-30-11-9-25/h2-7,12-13H,8-11,14H2,1H3,(H,24,27)