1-[4-[(3S)-3-[(3,4-dimethoxyphenyl)amino]piperidin-1-yl]-4-oxidanylidene-butyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[(3S)-3-[(3,4-dimethoxyphenyl)amino]piperidin-1-yl]-4-oxidanylidene-butyl]pyrrolidin-2-one Openeye Name: 1-[4-[(3S)-3-(3,4-dimethoxyanilino)-1-piperidyl]-4-oxo-butyl]pyrrolidin-2-one CAS Name: 1-[4-[(3S)-3-(3,4-dimethoxyanilino)-1-piperidinyl]-4-oxobutyl]-2-pyrrolidinone IUPAC Name: 1-[4-[(3S)-3-(3,4-dimethoxyanilino)piperidin-1-yl]-4-oxobutyl]pyrrolidin-2-one Traditional Name: 1-[4-[(3S)-3-(3,4-dimethoxyanilino)piperidino]-4-keto-butyl]-2-pyrrolidone Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2CCCN(C2)C(=O)CCCN3CCCC3=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N[C@H]2CCCN(C2)C(=O)CCCN3CCCC3=O)OC

InChI

InChI=1S/C21H31N3O4/c1-27-18-10-9-16(14-19(18)28-2)22-17-6-3-13-24(15-17)21(26)8-5-12-23-11-4-7-20(23)25/h9-10,14,17,22H,3-8,11-13,15H2,1-2H3/t17-/m0/s1