ethyl (3Z)-2-oxidanylidene-3-[phenyl-[[4-(piperazin-1-ylmethyl)phenyl]amino]methylidene]-1H-indole-6-carboxylate

Systemtic Name: ethyl (3Z)-2-oxidanylidene-3-[phenyl-[[4-(piperazin-1-ylmethyl)phenyl]amino]methylidene]-1H-indole-6-carboxylate Openeye Name: ethyl (3Z)-2-oxo-3-[phenyl-[4-(piperazin-1-ylmethyl)anilino]methylene]indoline-6-carboxylate CAS Name: (3Z)-2-oxo-3-[phenyl-[4-(1-piperazinylmethyl)anilino]methylidene]-1H-indole-6-carboxylic acid ethyl ester IUPAC Name: ethyl (3Z)-2-oxo-3-[phenyl-[4-(piperazin-1-ylmethyl)anilino]methylidene]-1H-indole-6-carboxylate Traditional Name: (3Z)-2-keto-3-[phenyl-[4-(piperazinomethyl)anilino]methylene]indoline-6-carboxylic acid ethyl ester Formula: C29H30N4O3 MolecularWeight: 482.5735

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)C(=C(C3=CC=CC=C3)NC4=CC=C(C=C4)CN5CCNCC5)C(=O)N2

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)/C(=C(\C3=CC=CC=C3)/NC4=CC=C(C=C4)CN5CCNCC5)/C(=O)N2

InChI

InChI=1S/C29H30N4O3/c1-2-36-29(35)22-10-13-24-25(18-22)32-28(34)26(24)27(21-6-4-3-5-7-21)31-23-11-8-20(9-12-23)19-33-16-14-30-15-17-33/h3-13,18,30-31H,2,14-17,19H2,1H3,(H,32,34)/b27-26-