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

Systemtic Name: methyl (3Z)-3-[[[4-[(2-acetamidoethylamino)methyl]phenyl]amino]-phenyl-methylidene]-2-oxidanylidene-1H-indole-6-carboxylate Openeye Name: methyl (3Z)-3-[[4-[(2-acetamidoethylamino)methyl]anilino]-phenyl-methylene]-2-oxo-indoline-6-carboxylate CAS Name: (3Z)-3-[[4-[(2-acetamidoethylamino)methyl]anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl (3Z)-3-[[4-[(2-acetamidoethylamino)methyl]anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylate Traditional Name: (3Z)-3-[[4-[(2-acetamidoethylamino)methyl]anilino]-phenyl-methylene]-2-keto-indoline-6-carboxylic acid methyl ester Formula: C28H28N4O4 MolecularWeight: 484.54632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNCC1=CC=C(C=C1)NC(=C2C3=C(C=C(C=C3)C(=O)OC)NC2=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNCC1=CC=C(C=C1)N/C(=C\2/C3=C(C=C(C=C3)C(=O)OC)NC2=O)/C4=CC=CC=C4

InChI

InChI=1S/C28H28N4O4/c1-18(33)30-15-14-29-17-19-8-11-22(12-9-19)31-26(20-6-4-3-5-7-20)25-23-13-10-21(28(35)36-2)16-24(23)32-27(25)34/h3-13,16,29,31H,14-15,17H2,1-2H3,(H,30,33)(H,32,34)/b26-25-