methyl 1-[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[(E)-3-(3,4-dichlorophenyl)-1-oxoprop-2-enyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[(E)-3-(3,4-dichlorophenyl)acryloyl]-4-phenyl-isonipecotic acid methyl ester Formula: C22H21Cl2NO3 MolecularWeight: 418.31304

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCN(CC1)C(=O)C=CC2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1(CCN(CC1)C(=O)/C=C/C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C22H21Cl2NO3/c1-28-21(27)22(17-5-3-2-4-6-17)11-13-25(14-12-22)20(26)10-8-16-7-9-18(23)19(24)15-16/h2-10,15H,11-14H2,1H3/b10-8+