N-[(E)-(2-oxidanylidene-1-propan-2-yl-indol-3-ylidene)amino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: N-[(E)-(2-oxidanylidene-1-propan-2-yl-indol-3-ylidene)amino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: N-[(E)-(1-isopropyl-2-oxo-indolin-3-ylidene)amino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: N-[(E)-(2-oxo-1-propan-2-yl-3-indolylidene)amino]-3-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: N-[(E)-(2-oxo-1-propan-2-ylindol-3-ylidene)amino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: N-[(E)-(1-isopropyl-2-keto-indolin-3-ylidene)amino]-3-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C24H30N5O2+ MolecularWeight: 420.5273

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC=CC=C2C(=NNC(=O)CC[NH+]3CCN(CC3)C4=CC=CC=C4)C1=O

Isomeric SMILES

CC(C)N1C2=CC=CC=C2/C(=N\NC(=O)CC[NH+]3CCN(CC3)C4=CC=CC=C4)/C1=O

InChI

InChI=1S/C24H29N5O2/c1-18(2)29-21-11-7-6-10-20(21)23(24(29)31)26-25-22(30)12-13-27-14-16-28(17-15-27)19-8-4-3-5-9-19/h3-11,18H,12-17H2,1-2H3,(H,25,30)/p+1/b26-23+