1-[1-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]-4-(1-methylpiperidin-4-yl)-2-(oxidanylidenemethylidene)piperidin-3-yl]-2-(1,2-dihydroimidazol-3-yl)piperidin-3-one

Systemtic Name: 1-[1-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]-4-(1-methylpiperidin-4-yl)-2-(oxidanylidenemethylidene)piperidin-3-yl]-2-(1,2-dihydroimidazol-3-yl)piperidin-3-one Openeye Name: 1-[1-[2-amino-3-(4-hydroxyphenyl)propanoyl]-4-(1-methyl-4-piperidyl)-2-(oxomethylene)-3-piperidyl]-2-(1,2-dihydroimidazol-3-yl)piperidin-3-one CAS Name: 1-[1-[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]-4-(1-methyl-4-piperidinyl)-2-(oxomethylidene)-3-piperidinyl]-2-(1,2-dihydroimidazol-3-yl)-3-piperidinone IUPAC Name: 1-[1-[2-amino-3-(4-hydroxyphenyl)propanoyl]-4-(1-methylpiperidin-4-yl)-2-(oxomethylidene)piperidin-3-yl]-2-(1,2-dihydroimidazol-3-yl)piperidin-3-one Traditional Name: 2-(4-imidazolin-1-yl)-1-[2-(ketomethylene)-4-(1-methyl-4-piperidyl)-1-tyrosyl-3-piperidyl]-3-piperidone Formula: C29H40N6O4 MolecularWeight: 536.6657

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2CCN(C(=C=O)C2N3CCCC(=O)C3N4CNC=C4)C(=O)C(CC5=CC=C(C=C5)O)N

Isomeric SMILES

CN1CCC(CC1)C2CCN(C(=C=O)C2N3CCCC(=O)C3N4CNC=C4)C(=O)C(CC5=CC=C(C=C5)O)N

InChI

InChI=1S/C29H40N6O4/c1-32-13-8-21(9-14-32)23-10-15-34(29(39)24(30)17-20-4-6-22(37)7-5-20)25(18-36)27(23)35-12-2-3-26(38)28(35)33-16-11-31-19-33/h4-7,11,16,21,23-24,27-28,31,37H,2-3,8-10,12-15,17,19,30H2,1H3