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

Systemtic Name: methyl (3Z)-3-[[[4-[(3-acetamidopropylamino)methyl]phenyl]amino]-phenyl-methylidene]-2-oxidanylidene-1H-indole-6-carboxylate Openeye Name: methyl (3Z)-3-[[4-[(3-acetamidopropylamino)methyl]anilino]-phenyl-methylene]-2-oxo-indoline-6-carboxylate CAS Name: (3Z)-3-[[4-[(3-acetamidopropylamino)methyl]anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl (3Z)-3-[[4-[(3-acetamidopropylamino)methyl]anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylate Traditional Name: (3Z)-3-[[4-[(3-acetamidopropylamino)methyl]anilino]-phenyl-methylene]-2-keto-indoline-6-carboxylic acid methyl ester Formula: C29H30N4O4 MolecularWeight: 498.5729

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCNCC1=CC=C(C=C1)NC(=C2C3=C(C=C(C=C3)C(=O)OC)NC2=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCCNCC1=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/C29H30N4O4/c1-19(34)31-16-6-15-30-18-20-9-12-23(13-10-20)32-27(21-7-4-3-5-8-21)26-24-14-11-22(29(36)37-2)17-25(24)33-28(26)35/h3-5,7-14,17,30,32H,6,15-16,18H2,1-2H3,(H,31,34)(H,33,35)/b27-26-