(4-aminocarbonylphenyl)methyl-[(3-methoxycarbonyl-2-oxidanyl-naphthalen-1-yl)methyl]-methyl-azanium

Systemtic Name: (4-aminocarbonylphenyl)methyl-[(3-methoxycarbonyl-2-oxidanyl-naphthalen-1-yl)methyl]-methyl-azanium Openeye Name: (4-carbamoylphenyl)methyl-[(2-hydroxy-3-methoxycarbonyl-1-naphthyl)methyl]-methyl-ammonium CAS Name: (4-carbamoylphenyl)methyl-[(2-hydroxy-3-methoxycarbonyl-1-naphthalenyl)methyl]-methylammonium IUPAC Name: (4-carbamoylphenyl)methyl-[(2-hydroxy-3-methoxycarbonylnaphthalen-1-yl)methyl]-methylazanium Traditional Name: (4-carbamoylbenzyl)-[(3-carbomethoxy-2-hydroxy-1-naphthyl)methyl]-methyl-ammonium Formula: C22H23N2O4+ MolecularWeight: 379.42902

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)C(=O)N)CC2=C(C(=CC3=CC=CC=C32)C(=O)OC)O

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)C(=O)N)CC2=C(C(=CC3=CC=CC=C32)C(=O)OC)O

InChI

InChI=1S/C22H22N2O4/c1-24(12-14-7-9-15(10-8-14)21(23)26)13-19-17-6-4-3-5-16(17)11-18(20(19)25)22(27)28-2/h3-11,25H,12-13H2,1-2H3,(H2,23,26)/p+1