[4-[2-[4-(4-aminocarbonylphenyl)butan-2-ylamino]-1-oxidanyl-ethyl]-2-oxidanyl-phenyl] ethanoate

Systemtic Name: [4-[2-[4-(4-aminocarbonylphenyl)butan-2-ylamino]-1-oxidanyl-ethyl]-2-oxidanyl-phenyl] ethanoate Openeye Name: [4-[2-[[3-(4-carbamoylphenyl)-1-methyl-propyl]amino]-1-hydroxy-ethyl]-2-hydroxy-phenyl] acetate CAS Name: acetic acid [4-[2-[4-(4-carbamoylphenyl)butan-2-ylamino]-1-hydroxyethyl]-2-hydroxyphenyl] ester IUPAC Name: [4-[2-[4-(4-carbamoylphenyl)butan-2-ylamino]-1-hydroxyethyl]-2-hydroxyphenyl] acetate Traditional Name: acetic acid [4-[2-[[3-(4-carbamoylphenyl)-1-methyl-propyl]amino]-1-hydroxy-ethyl]-2-hydroxy-phenyl] ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)C(=O)N)NCC(C2=CC(=C(C=C2)OC(=O)C)O)O

Isomeric SMILES

CC(CCC1=CC=C(C=C1)C(=O)N)NCC(C2=CC(=C(C=C2)OC(=O)C)O)O

InChI

InChI=1S/C21H26N2O5/c1-13(3-4-15-5-7-16(8-6-15)21(22)27)23-12-19(26)17-9-10-20(18(25)11-17)28-14(2)24/h5-11,13,19,23,25-26H,3-4,12H2,1-2H3,(H2,22,27)