[2-(4-aminocarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl] (E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoate

Systemtic Name: [2-(4-aminocarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl] (E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoate Openeye Name: [2-(4-carbamoyl-1-piperidyl)-2-oxo-ethyl] (E)-3-(3-chloro-4-methyl-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-4-methylphenyl)-2-propenoic acid [2-(4-carbamoyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-carbamoylpiperidin-1-yl)-2-oxoethyl] (E)-3-(3-chloro-4-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-4-methyl-phenyl)acrylic acid [2-(4-carbamoylpiperidino)-2-keto-ethyl] ester Formula: C18H21ClN2O4 MolecularWeight: 364.82334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=CC(=O)OCC(=O)N2CCC(CC2)C(=O)N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C/C(=O)OCC(=O)N2CCC(CC2)C(=O)N)Cl

InChI

InChI=1S/C18H21ClN2O4/c1-12-2-3-13(10-15(12)19)4-5-17(23)25-11-16(22)21-8-6-14(7-9-21)18(20)24/h2-5,10,14H,6-9,11H2,1H3,(H2,20,24)/b5-4+