(4-ethylphenyl)methyl-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-ethylphenyl)methyl-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-ethylphenyl)methyl-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-ethylphenyl)methyl-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxoethyl]-methylammonium IUPAC Name: (4-ethylphenyl)methyl-[2-[(4-methoxycarbonylphenyl)methylamino]-2-oxoethyl]-methylazanium Traditional Name: [2-[(4-carbomethoxybenzyl)amino]-2-keto-ethyl]-(4-ethylbenzyl)-methyl-ammonium Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)NCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)NCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H26N2O3/c1-4-16-5-7-18(8-6-16)14-23(2)15-20(24)22-13-17-9-11-19(12-10-17)21(25)26-3/h5-12H,4,13-15H2,1-3H3,(H,22,24)/p+1