N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-3-(2-oxidanylidenepyrrolidin-1-yl)propanamide

Systemtic Name: N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-3-(2-oxidanylidenepyrrolidin-1-yl)propanamide Openeye Name: N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-3-(2-oxopyrrolidin-1-yl)propanamide CAS Name: N-[(3S)-1-[(3-methoxyphenyl)methyl]-3-piperidin-1-iumyl]-3-(2-oxo-1-pyrrolidinyl)propanamide IUPAC Name: N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-3-(2-oxopyrrolidin-1-yl)propanamide Traditional Name: 3-(2-ketopyrrolidino)-N-[(3S)-1-m-anisylpiperidin-1-ium-3-yl]propionamide Formula: C20H30N3O3+ MolecularWeight: 360.4705

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CCCC(C2)NC(=O)CCN3CCCC3=O

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CCC[C@@H](C2)NC(=O)CCN3CCCC3=O

InChI

InChI=1S/C20H29N3O3/c1-26-18-7-2-5-16(13-18)14-22-10-3-6-17(15-22)21-19(24)9-12-23-11-4-8-20(23)25/h2,5,7,13,17H,3-4,6,8-12,14-15H2,1H3,(H,21,24)/p+1/t17-/m0/s1