[2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 3-chloranyl-4-ethoxy-5-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 3-chloranyl-4-ethoxy-5-methoxy-benzoate Openeye Name: [2-[benzyl(isopropyl)amino]-2-oxo-ethyl] 3-chloro-4-ethoxy-5-methoxy-benzoate CAS Name: 3-chloro-4-ethoxy-5-methoxybenzoic acid [2-oxo-2-[(phenylmethyl)-propan-2-ylamino]ethyl] ester IUPAC Name: [2-[benzyl(propan-2-yl)amino]-2-oxoethyl] 3-chloro-4-ethoxy-5-methoxybenzoate Traditional Name: 3-chloro-4-ethoxy-5-methoxy-benzoic acid [2-[benzyl(isopropyl)amino]-2-keto-ethyl] ester Formula: C22H26ClNO5 MolecularWeight: 419.89854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)N(CC2=CC=CC=C2)C(C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)N(CC2=CC=CC=C2)C(C)C)OC

InChI

InChI=1S/C22H26ClNO5/c1-5-28-21-18(23)11-17(12-19(21)27-4)22(26)29-14-20(25)24(15(2)3)13-16-9-7-6-8-10-16/h6-12,15H,5,13-14H2,1-4H3