[1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-[(2S)-2-phenylpropyl]-4-piperidin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-yl]-pyrrolidino-methanone Formula: C19H29N2O+ MolecularWeight: 301.44636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCC(CC1)C(=O)N2CCCC2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C[NH+]1CCC(CC1)C(=O)N2CCCC2)C3=CC=CC=C3

InChI

InChI=1S/C19H28N2O/c1-16(17-7-3-2-4-8-17)15-20-13-9-18(10-14-20)19(22)21-11-5-6-12-21/h2-4,7-8,16,18H,5-6,9-15H2,1H3/p+1/t16-/m1/s1