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

Systemtic Name: 4-chloranyl-N-[(Z)-3-(3-morpholin-4-ium-4-ylpropylamino)-3-oxidanylidene-1-(3-phenoxyphenyl)prop-1-en-2-yl]benzamide Openeye Name: 4-chloro-N-[(Z)-1-(3-morpholin-4-ium-4-ylpropylcarbamoyl)-2-(3-phenoxyphenyl)vinyl]benzamide CAS Name: 4-chloro-N-[(Z)-3-[3-(4-morpholin-4-iumyl)propylamino]-3-oxo-1-(3-phenoxyphenyl)prop-1-en-2-yl]benzamide IUPAC Name: 4-chloro-N-[(Z)-3-(3-morpholin-4-ium-4-ylpropylamino)-3-oxo-1-(3-phenoxyphenyl)prop-1-en-2-yl]benzamide Traditional Name: 4-chloro-N-[(Z)-1-(3-morpholin-4-ium-4-ylpropylcarbamoyl)-2-(3-phenoxyphenyl)vinyl]benzamide Formula: C29H31ClN3O4+ MolecularWeight: 521.02714

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C(=CC2=CC(=CC=C2)OC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)/C(=C/C2=CC(=CC=C2)OC3=CC=CC=C3)/NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H30ClN3O4/c30-24-12-10-23(11-13-24)28(34)32-27(29(35)31-14-5-15-33-16-18-36-19-17-33)21-22-6-4-9-26(20-22)37-25-7-2-1-3-8-25/h1-4,6-13,20-21H,5,14-19H2,(H,31,35)(H,32,34)/p+1/b27-21-