[6-[4-(4-aminocarbonylphenyl)butan-2-ylamino]-1-(phenoxymethyl)cyclohexa-2,4-dien-1-yl] ethanoate

Systemtic Name: [6-[4-(4-aminocarbonylphenyl)butan-2-ylamino]-1-(phenoxymethyl)cyclohexa-2,4-dien-1-yl] ethanoate Openeye Name: [6-[[3-(4-carbamoylphenyl)-1-methyl-propyl]amino]-1-(phenoxymethyl)cyclohexa-2,4-dien-1-yl] acetate CAS Name: acetic acid [6-[4-(4-carbamoylphenyl)butan-2-ylamino]-1-(phenoxymethyl)-1-cyclohexa-2,4-dienyl] ester IUPAC Name: [6-[4-(4-carbamoylphenyl)butan-2-ylamino]-1-(phenoxymethyl)cyclohexa-2,4-dien-1-yl] acetate Traditional Name: acetic acid [6-[[3-(4-carbamoylphenyl)-1-methyl-propyl]amino]-1-(phenoxymethyl)cyclohexa-2,4-dien-1-yl] ester Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)C(=O)N)NC2C=CC=CC2(COC3=CC=CC=C3)OC(=O)C

Isomeric SMILES

CC(CCC1=CC=C(C=C1)C(=O)N)NC2C=CC=CC2(COC3=CC=CC=C3)OC(=O)C

InChI

InChI=1S/C26H30N2O4/c1-19(11-12-21-13-15-22(16-14-21)25(27)30)28-24-10-6-7-17-26(24,32-20(2)29)18-31-23-8-4-3-5-9-23/h3-10,13-17,19,24,28H,11-12,18H2,1-2H3,(H2,27,30)