(4-methoxycarbonylphenyl)methyl-[2-[(2R)-1-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-2-yl]ethyl]azanium

Systemtic Name: (4-methoxycarbonylphenyl)methyl-[2-[(2R)-1-(naphthalen-1-ylmethyl)-5-oxidanylidene-pyrrolidin-2-yl]ethyl]azanium Openeye Name: (4-methoxycarbonylphenyl)methyl-[2-[(2R)-1-(1-naphthylmethyl)-5-oxo-pyrrolidin-2-yl]ethyl]ammonium CAS Name: (4-methoxycarbonylphenyl)methyl-[2-[(2R)-1-(1-naphthalenylmethyl)-5-oxo-2-pyrrolidinyl]ethyl]ammonium IUPAC Name: (4-methoxycarbonylphenyl)methyl-[2-[(2R)-1-(naphthalen-1-ylmethyl)-5-oxopyrrolidin-2-yl]ethyl]azanium Traditional Name: (4-carbomethoxybenzyl)-[2-[(2R)-5-keto-1-(1-naphthylmethyl)pyrrolidin-2-yl]ethyl]ammonium Formula: C26H29N2O3+ MolecularWeight: 417.52006

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C[NH2+]CCC2CCC(=O)N2CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C[NH2+]CC[C@H]2CCC(=O)N2CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H28N2O3/c1-31-26(30)21-11-9-19(10-12-21)17-27-16-15-23-13-14-25(29)28(23)18-22-7-4-6-20-5-2-3-8-24(20)22/h2-12,23,27H,13-18H2,1H3/p+1/t23-/m1/s1