N-[(E)-[4-chloranyl-1-[(4-methylpiperazin-1-yl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]-4-phenylmethoxy-benzamide

Systemtic Name: N-[(E)-[4-chloranyl-1-[(4-methylpiperazin-1-yl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]-4-phenylmethoxy-benzamide Openeye Name: 4-benzyloxy-N-[(E)-[4-chloro-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-indolin-3-ylidene]amino]benzamide CAS Name: N-[(E)-[4-chloro-1-[(4-methyl-1-piperazinyl)methyl]-2-oxo-3-indolylidene]amino]-4-phenylmethoxybenzamide IUPAC Name: N-[(E)-[4-chloro-1-[(4-methylpiperazin-1-yl)methyl]-2-oxoindol-3-ylidene]amino]-4-phenylmethoxybenzamide Traditional Name: 4-benzoxy-N-[(E)-[4-chloro-2-keto-1-[(4-methylpiperazino)methyl]indolin-3-ylidene]amino]benzamide Formula: C28H28ClN5O3 MolecularWeight: 518.00662

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CN2C3=C(C(=CC=C3)Cl)C(=NNC(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5)C2=O

Isomeric SMILES

CN1CCN(CC1)CN2C3=C(C(=CC=C3)Cl)/C(=N\NC(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5)/C2=O

InChI

InChI=1S/C28H28ClN5O3/c1-32-14-16-33(17-15-32)19-34-24-9-5-8-23(29)25(24)26(28(34)36)30-31-27(35)21-10-12-22(13-11-21)37-18-20-6-3-2-4-7-20/h2-13H,14-19H2,1H3,(H,31,35)/b30-26+