2,3-dihydro-1H-inden-1-yl 2-acetamido-2-[2-[(2-methylphenyl)amino]-1,3-benzoxazol-6-yl]ethanoate

Systemtic Name: 2,3-dihydro-1H-inden-1-yl 2-acetamido-2-[2-[(2-methylphenyl)amino]-1,3-benzoxazol-6-yl]ethanoate Openeye Name: indan-1-yl 2-acetamido-2-[2-(2-methylanilino)-1,3-benzoxazol-6-yl]acetate CAS Name: 2-acetamido-2-[2-(2-methylanilino)-1,3-benzoxazol-6-yl]acetic acid 2,3-dihydro-1H-inden-1-yl ester IUPAC Name: 2,3-dihydro-1H-inden-1-yl 2-acetamido-2-[2-(2-methylanilino)-1,3-benzoxazol-6-yl]acetate Traditional Name: 2-acetamido-2-[2-(o-toluidino)-1,3-benzoxazol-6-yl]acetic acid indan-1-yl ester Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC3=C(O2)C=C(C=C3)C(C(=O)OC4CCC5=CC=CC=C45)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1NC2=NC3=C(O2)C=C(C=C3)C(C(=O)OC4CCC5=CC=CC=C45)NC(=O)C

InChI

InChI=1S/C27H25N3O4/c1-16-7-3-6-10-21(16)29-27-30-22-13-11-19(15-24(22)34-27)25(28-17(2)31)26(32)33-23-14-12-18-8-4-5-9-20(18)23/h3-11,13,15,23,25H,12,14H2,1-2H3,(H,28,31)(H,29,30)