2-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 2-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: 2-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide CAS Name: 2-[[(E)-3-(3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 2-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: 2-[[(E)-3-(3-methoxyphenyl)acryloyl]amino]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C24H30N3O4+ MolecularWeight: 424.5127

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=CC(=O)NC2=CC=CC=C2C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=CC(=C1)/C=C/C(=O)NC2=CC=CC=C2C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C24H29N3O4/c1-30-20-7-4-6-19(18-20)10-11-23(28)26-22-9-3-2-8-21(22)24(29)25-12-5-13-27-14-16-31-17-15-27/h2-4,6-11,18H,5,12-17H2,1H3,(H,25,29)(H,26,28)/p+1/b11-10+