methyl 4-[[2-[(2S)-1-butyl-5-oxidanylidene-pyrrolidin-2-yl]ethylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[(2S)-1-butyl-5-oxidanylidene-pyrrolidin-2-yl]ethylamino]methyl]benzoate Openeye Name: methyl 4-[[2-[(2S)-1-butyl-5-oxo-pyrrolidin-2-yl]ethylamino]methyl]benzoate CAS Name: 4-[[2-[(2S)-1-butyl-5-oxo-2-pyrrolidinyl]ethylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(2S)-1-butyl-5-oxopyrrolidin-2-yl]ethylamino]methyl]benzoate Traditional Name: 4-[[2-[(2S)-1-butyl-5-keto-pyrrolidin-2-yl]ethylamino]methyl]benzoic acid methyl ester Formula: C19H28N2O3 MolecularWeight: 332.43722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(CCC1=O)CCNCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCN1[C@@H](CCC1=O)CCNCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H28N2O3/c1-3-4-13-21-17(9-10-18(21)22)11-12-20-14-15-5-7-16(8-6-15)19(23)24-2/h5-8,17,20H,3-4,9-14H2,1-2H3/t17-/m0/s1