methyl 4-[2-azanylethyl-(4-methoxycarbonylphenyl)carbonyl-carbamoyl]benzoate

Systemtic Name: methyl 4-[2-azanylethyl-(4-methoxycarbonylphenyl)carbonyl-carbamoyl]benzoate Openeye Name: methyl 4-[2-aminoethyl-(4-methoxycarbonylbenzoyl)carbamoyl]benzoate CAS Name: 4-[[2-aminoethyl-[(4-methoxycarbonylphenyl)-oxomethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-aminoethyl-(4-methoxycarbonylbenzoyl)carbamoyl]benzoate Traditional Name: 4-[2-aminoethyl-(4-carbomethoxybenzoyl)carbamoyl]benzoic acid methyl ester Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N(CCN)C(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N(CCN)C(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H20N2O6/c1-27-19(25)15-7-3-13(4-8-15)17(23)22(12-11-21)18(24)14-5-9-16(10-6-14)20(26)28-2/h3-10H,11-12,21H2,1-2H3