[2-[(4-benzamido-2,5-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: [2-[(4-benzamido-2,5-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium Openeye Name: [2-(4-benzamido-2,5-dimethoxy-anilino)-2-oxo-ethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]ammonium CAS Name: [2-(4-benzamido-2,5-dimethoxyanilino)-2-oxoethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: [2-(4-benzamido-2,5-dimethoxyanilino)-2-oxoethyl]-cyclopropyl-[(4-methoxyphenyl)methyl]azanium Traditional Name: [2-(4-benzamido-2,5-dimethoxy-anilino)-2-keto-ethyl]-cyclopropyl-p-anisyl-ammonium Formula: C28H32N3O5+ MolecularWeight: 490.57078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+](CC(=O)NC2=C(C=C(C(=C2)OC)NC(=O)C3=CC=CC=C3)OC)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+](CC(=O)NC2=C(C=C(C(=C2)OC)NC(=O)C3=CC=CC=C3)OC)C4CC4

InChI

InChI=1S/C28H31N3O5/c1-34-22-13-9-19(10-14-22)17-31(21-11-12-21)18-27(32)29-23-15-26(36-3)24(16-25(23)35-2)30-28(33)20-7-5-4-6-8-20/h4-10,13-16,21H,11-12,17-18H2,1-3H3,(H,29,32)(H,30,33)/p+1