methyl (3Z)-3-[[[4-[(4-methylpiperazin-1-yl)carbamoyl]phenyl]amino]-phenyl-methylidene]-2-oxidanylidene-1H-indole-6-carboxylate

Systemtic Name: methyl (3Z)-3-[[[4-[(4-methylpiperazin-1-yl)carbamoyl]phenyl]amino]-phenyl-methylidene]-2-oxidanylidene-1H-indole-6-carboxylate Openeye Name: methyl (3Z)-3-[[4-[(4-methylpiperazin-1-yl)carbamoyl]anilino]-phenyl-methylene]-2-oxo-indoline-6-carboxylate CAS Name: (3Z)-3-[[4-[[(4-methyl-1-piperazinyl)amino]-oxomethyl]anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl (3Z)-3-[[4-[(4-methylpiperazin-1-yl)carbamoyl]anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylate Traditional Name: (3Z)-2-keto-3-[[4-[(4-methylpiperazino)carbamoyl]anilino]-phenyl-methylene]indoline-6-carboxylic acid methyl ester Formula: C29H29N5O4 MolecularWeight: 511.57166

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC(=O)C2=CC=C(C=C2)NC(=C3C4=C(C=C(C=C4)C(=O)OC)NC3=O)C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)NC(=O)C2=CC=C(C=C2)N/C(=C\3/C4=C(C=C(C=C4)C(=O)OC)NC3=O)/C5=CC=CC=C5

InChI

InChI=1S/C29H29N5O4/c1-33-14-16-34(17-15-33)32-27(35)20-8-11-22(12-9-20)30-26(19-6-4-3-5-7-19)25-23-13-10-21(29(37)38-2)18-24(23)31-28(25)36/h3-13,18,30H,14-17H2,1-2H3,(H,31,36)(H,32,35)/b26-25-