(2S)-2-[[(E)-3-(3-phenoxyphenyl)prop-2-enoyl]amino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[[(E)-3-(3-phenoxyphenyl)prop-2-enoyl]amino]-N-propyl-propanamide Openeye Name: (2S)-2-[[(E)-3-(3-phenoxyphenyl)prop-2-enoyl]amino]-N-propyl-propanamide CAS Name: (2S)-2-[[(E)-1-oxo-3-(3-phenoxyphenyl)prop-2-enyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[[(E)-3-(3-phenoxyphenyl)prop-2-enoyl]amino]-N-propylpropanamide Traditional Name: (2S)-2-[[(E)-3-(3-phenoxyphenyl)acryloyl]amino]-N-propyl-propionamide Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C=CC1=CC(=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)/C=C/C1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O3/c1-3-14-22-21(25)16(2)23-20(24)13-12-17-8-7-11-19(15-17)26-18-9-5-4-6-10-18/h4-13,15-16H,3,14H2,1-2H3,(H,22,25)(H,23,24)/b13-12+/t16-/m0/s1