2-azanyl-3-(4-hydroxyphenyl)-N-[(E)-5-methyl-1-quinolin-2-yl-hex-1-en-3-yl]propanamide

Systemtic Name: 2-azanyl-3-(4-hydroxyphenyl)-N-[(E)-5-methyl-1-quinolin-2-yl-hex-1-en-3-yl]propanamide Openeye Name: 2-amino-3-(4-hydroxyphenyl)-N-[3-methyl-1-[(E)-2-(2-quinolyl)vinyl]butyl]propanamide CAS Name: 2-amino-3-(4-hydroxyphenyl)-N-[(E)-5-methyl-1-(2-quinolinyl)hex-1-en-3-yl]propanamide IUPAC Name: 2-amino-3-(4-hydroxyphenyl)-N-[(E)-5-methyl-1-quinolin-2-ylhex-1-en-3-yl]propanamide Traditional Name: 2-amino-3-(4-hydroxyphenyl)-N-[(E)-1-isobutyl-3-(2-quinolyl)allyl]propionamide Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=CC1=NC2=CC=CC=C2C=C1)NC(=O)C(CC3=CC=C(C=C3)O)N

Isomeric SMILES

CC(C)CC(/C=C/C1=NC2=CC=CC=C2C=C1)NC(=O)C(CC3=CC=C(C=C3)O)N

InChI

InChI=1S/C25H29N3O2/c1-17(2)15-21(12-11-20-10-9-19-5-3-4-6-24(19)27-20)28-25(30)23(26)16-18-7-13-22(29)14-8-18/h3-14,17,21,23,29H,15-16,26H2,1-2H3,(H,28,30)/b12-11+