[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 3-methoxy-4-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 3-methoxy-4-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 3-methoxy-4-[2-(2-methoxyanilino)-2-oxo-ethoxy]benzoate CAS Name: 3-methoxy-4-[2-(2-methoxyanilino)-2-oxoethoxy]benzoic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 3-methoxy-4-[2-(2-methoxyanilino)-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-(o-anisidino)ethoxy]-3-methoxy-benzoic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C29H34N2O7 MolecularWeight: 522.58946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)COC2=C(C=C(C=C2)C(=O)OCC(=O)NC34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=CC=CC=C1NC(=O)COC2=C(C=C(C=C2)C(=O)OCC(=O)NC34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C29H34N2O7/c1-35-23-6-4-3-5-22(23)30-26(32)16-37-24-8-7-21(12-25(24)36-2)28(34)38-17-27(33)31-29-13-18-9-19(14-29)11-20(10-18)15-29/h3-8,12,18-20H,9-11,13-17H2,1-2H3,(H,30,32)(H,31,33)