4-methyl-N-[(Z)-1-(1-methylindol-3-yl)-3-(3-morpholin-4-ium-4-ylpropylamino)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: 4-methyl-N-[(Z)-1-(1-methylindol-3-yl)-3-(3-morpholin-4-ium-4-ylpropylamino)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: 4-methyl-N-[(Z)-2-(1-methylindol-3-yl)-1-(3-morpholin-4-ium-4-ylpropylcarbamoyl)vinyl]benzamide CAS Name: 4-methyl-N-[(Z)-1-(1-methyl-3-indolyl)-3-[3-(4-morpholin-4-iumyl)propylamino]-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: 4-methyl-N-[(Z)-1-(1-methylindol-3-yl)-3-(3-morpholin-4-ium-4-ylpropylamino)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: 4-methyl-N-[(Z)-2-(1-methylindol-3-yl)-1-(3-morpholin-4-ium-4-ylpropylcarbamoyl)vinyl]benzamide Formula: C27H33N4O3+ MolecularWeight: 461.57592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CN(C3=CC=CC=C32)C)C(=O)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CN(C3=CC=CC=C32)C)/C(=O)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C27H32N4O3/c1-20-8-10-21(11-9-20)26(32)29-24(18-22-19-30(2)25-7-4-3-6-23(22)25)27(33)28-12-5-13-31-14-16-34-17-15-31/h3-4,6-11,18-19H,5,12-17H2,1-2H3,(H,28,33)(H,29,32)/p+1/b24-18-