methyl-[(3S)-1-[4-(2-oxidanylidenepyrrolidin-1-yl)butanoyl]piperidin-3-yl]-phenethyl-azanium

Systemtic Name: methyl-[(3S)-1-[4-(2-oxidanylidenepyrrolidin-1-yl)butanoyl]piperidin-3-yl]-phenethyl-azanium Openeye Name: methyl-[(3S)-1-[4-(2-oxopyrrolidin-1-yl)butanoyl]-3-piperidyl]-phenethyl-ammonium CAS Name: methyl-[(3S)-1-[1-oxo-4-(2-oxo-1-pyrrolidinyl)butyl]-3-piperidinyl]-phenethylammonium IUPAC Name: methyl-[(3S)-1-[4-(2-oxopyrrolidin-1-yl)butanoyl]piperidin-3-yl]-phenethylazanium Traditional Name: [(3S)-1-[4-(2-ketopyrrolidino)butanoyl]-3-piperidyl]-methyl-phenethyl-ammonium Formula: C22H34N3O2+ MolecularWeight: 372.52426

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCCN(C2)C(=O)CCCN3CCCC3=O

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)[C@H]2CCCN(C2)C(=O)CCCN3CCCC3=O

InChI

InChI=1S/C22H33N3O2/c1-23(17-13-19-8-3-2-4-9-19)20-10-5-16-25(18-20)22(27)12-7-15-24-14-6-11-21(24)26/h2-4,8-9,20H,5-7,10-18H2,1H3/p+1/t20-/m0/s1