methyl 1-[(3R)-1-(3-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[(3R)-1-(3-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[(3R)-1-(m-tolyl)-2,5-dioxo-pyrrolidin-3-yl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(3R)-1-(3-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[(3R)-1-(3-methylphenyl)-2,5-dioxopyrrolidin-3-yl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(3R)-2,5-diketo-1-(m-tolyl)pyrrolidin-3-yl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C18H23N2O4+ MolecularWeight: 331.38622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)CC(C2=O)[NH+]3CCC(CC3)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C[C@H](C2=O)[NH+]3CCC(CC3)C(=O)OC

InChI

InChI=1S/C18H22N2O4/c1-12-4-3-5-14(10-12)20-16(21)11-15(17(20)22)19-8-6-13(7-9-19)18(23)24-2/h3-5,10,13,15H,6-9,11H2,1-2H3/p+1/t15-/m1/s1