[2-(cycloheptylamino)-2-oxidanylidene-ethyl] 2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [2-(cycloheptylamino)-2-oxidanylidene-ethyl] 2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethanoate Openeye Name: [2-(cycloheptylamino)-2-oxo-ethyl] 2-[(3,4,5-trimethoxybenzoyl)amino]acetate CAS Name: 2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]acetic acid [2-(cycloheptylamino)-2-oxoethyl] ester IUPAC Name: [2-(cycloheptylamino)-2-oxoethyl] 2-[(3,4,5-trimethoxybenzoyl)amino]acetate Traditional Name: 2-[(3,4,5-trimethoxybenzoyl)amino]acetic acid [2-(cycloheptylamino)-2-keto-ethyl] ester Formula: C21H30N2O7 MolecularWeight: 422.4721

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)OCC(=O)NC2CCCCCC2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)OCC(=O)NC2CCCCCC2

InChI

InChI=1S/C21H30N2O7/c1-27-16-10-14(11-17(28-2)20(16)29-3)21(26)22-12-19(25)30-13-18(24)23-15-8-6-4-5-7-9-15/h10-11,15H,4-9,12-13H2,1-3H3,(H,22,26)(H,23,24)