[2-[2-[methyl-[(1S)-1-phenyl-2-pyrrolidin-1-yl-ethyl]amino]-2-oxidanylidene-ethyl]phenyl] butanoate

Systemtic Name: [2-[2-[methyl-[(1S)-1-phenyl-2-pyrrolidin-1-yl-ethyl]amino]-2-oxidanylidene-ethyl]phenyl] butanoate Openeye Name: [2-[2-[methyl-[(1S)-1-phenyl-2-pyrrolidin-1-yl-ethyl]amino]-2-oxo-ethyl]phenyl] butanoate CAS Name: butanoic acid [2-[2-[methyl-[(1S)-1-phenyl-2-(1-pyrrolidinyl)ethyl]amino]-2-oxoethyl]phenyl] ester IUPAC Name: [2-[2-[methyl-[(1S)-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-2-oxoethyl]phenyl] butanoate Traditional Name: butyric acid [2-[2-keto-2-[methyl-[(1S)-1-phenyl-2-pyrrolidino-ethyl]amino]ethyl]phenyl] ester Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=CC=C1CC(=O)N(C)C(CN2CCCC2)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)OC1=CC=CC=C1CC(=O)N(C)[C@H](CN2CCCC2)C3=CC=CC=C3

InChI

InChI=1S/C25H32N2O3/c1-3-11-25(29)30-23-15-8-7-14-21(23)18-24(28)26(2)22(19-27-16-9-10-17-27)20-12-5-4-6-13-20/h4-8,12-15,22H,3,9-11,16-19H2,1-2H3/t22-/m1/s1