(2S,4S)-N,N-diethyl-4-[(1-ethylpiperidin-1-ium-4-yl)amino]-1-(naphthalen-1-ylmethyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S,4S)-N,N-diethyl-4-[(1-ethylpiperidin-1-ium-4-yl)amino]-1-(naphthalen-1-ylmethyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S,4S)-N,N-diethyl-4-[(1-ethylpiperidin-1-ium-4-yl)amino]-1-(1-naphthylmethyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2S,4S)-N,N-diethyl-4-[(1-ethyl-4-piperidin-1-iumyl)amino]-1-(1-naphthalenylmethyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S,4S)-N,N-diethyl-4-[(1-ethylpiperidin-1-ium-4-yl)amino]-1-(naphthalen-1-ylmethyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S,4S)-N,N-diethyl-4-[(1-ethylpiperidin-1-ium-4-yl)amino]-1-(1-naphthylmethyl)pyrrolidin-1-ium-2-carboxamide Formula: C27H42N4O+2 MolecularWeight: 438.64858

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC2CC([NH+](C2)CC3=CC=CC4=CC=CC=C43)C(=O)N(CC)CC

Isomeric SMILES

CC[NH+]1CCC(CC1)N[C@H]2C[C@H]([NH+](C2)CC3=CC=CC4=CC=CC=C43)C(=O)N(CC)CC

InChI

InChI=1S/C27H40N4O/c1-4-29-16-14-23(15-17-29)28-24-18-26(27(32)30(5-2)6-3)31(20-24)19-22-12-9-11-21-10-7-8-13-25(21)22/h7-13,23-24,26,28H,4-6,14-20H2,1-3H3/p+2/t24-,26-/m0/s1