3-(4-ethoxyphenyl)imino-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]indol-2-one

Systemtic Name: 3-(4-ethoxyphenyl)imino-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]indol-2-one Openeye Name: 3-(4-ethoxyphenyl)imino-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]indolin-2-one CAS Name: 3-(4-ethoxyphenyl)imino-1-[(4-phenyl-1-piperazin-1-iumyl)methyl]-2-indolone IUPAC Name: 3-(4-ethoxyphenyl)imino-1-[(4-phenylpiperazin-1-ium-1-yl)methyl]indol-2-one Traditional Name: 1-[(4-phenylpiperazin-1-ium-1-yl)methyl]-3-p-phenetylimino-oxindole Formula: C27H29N4O2+ MolecularWeight: 441.54476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)C[NH+]4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)C[NH+]4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H28N4O2/c1-2-33-23-14-12-21(13-15-23)28-26-24-10-6-7-11-25(24)31(27(26)32)20-29-16-18-30(19-17-29)22-8-4-3-5-9-22/h3-15H,2,16-20H2,1H3/p+1