[2-[[4-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl] 2-(2-aminocarbonylphenoxy)ethanoate

Systemtic Name: [2-[[4-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl] 2-(2-aminocarbonylphenoxy)ethanoate Openeye Name: [2-[4-(azepan-1-yl)anilino]-2-oxo-ethyl] 2-(2-carbamoylphenoxy)acetate CAS Name: 2-(2-carbamoylphenoxy)acetic acid [2-[4-(1-azepanyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(azepan-1-yl)anilino]-2-oxoethyl] 2-(2-carbamoylphenoxy)acetate Traditional Name: 2-(2-carbamoylphenoxy)acetic acid [2-[4-(azepan-1-yl)anilino]-2-keto-ethyl] ester Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)COC(=O)COC3=CC=CC=C3C(=O)N

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)COC(=O)COC3=CC=CC=C3C(=O)N

InChI

InChI=1S/C23H27N3O5/c24-23(29)19-7-3-4-8-20(19)30-16-22(28)31-15-21(27)25-17-9-11-18(12-10-17)26-13-5-1-2-6-14-26/h3-4,7-12H,1-2,5-6,13-16H2,(H2,24,29)(H,25,27)