N-[(Z)-3-oxidanylidene-3-(2-pyrrolidin-1-ium-1-ylethylamino)-1-(1H-pyrrol-2-yl)prop-1-en-2-yl]benzamide

Systemtic Name: N-[(Z)-3-oxidanylidene-3-(2-pyrrolidin-1-ium-1-ylethylamino)-1-(1H-pyrrol-2-yl)prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-1-(2-pyrrolidin-1-ium-1-ylethylcarbamoyl)-2-(1H-pyrrol-2-yl)vinyl]benzamide CAS Name: N-[(Z)-3-oxo-3-[2-(1-pyrrolidin-1-iumyl)ethylamino]-1-(1H-pyrrol-2-yl)prop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-oxo-3-(2-pyrrolidin-1-ium-1-ylethylamino)-1-(1H-pyrrol-2-yl)prop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-1-(2-pyrrolidin-1-ium-1-ylethylcarbamoyl)-2-(1H-pyrrol-2-yl)vinyl]benzamide Formula: C20H25N4O2+ MolecularWeight: 353.4381

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC(=O)C(=CC2=CC=CN2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)CCNC(=O)/C(=C/C2=CC=CN2)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H24N4O2/c25-19(16-7-2-1-3-8-16)23-18(15-17-9-6-10-21-17)20(26)22-11-14-24-12-4-5-13-24/h1-3,6-10,15,21H,4-5,11-14H2,(H,22,26)(H,23,25)/p+1/b18-15-