2-[(2-methylpropan-2-yl)oxycarbonyl-phenyl-amino]ethanoic acid; (phenylmethyl) 6-aminocarbonyl-2,3-dihydroindole-1-carboxylate

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-phenyl-amino]ethanoic acid; (phenylmethyl) 6-aminocarbonyl-2,3-dihydroindole-1-carboxylate Openeye Name: benzyl 6-carbamoylindoline-1-carboxylate; 2-(N-tert-butoxycarbonylanilino)acetic acid CAS Name: 6-carbamoyl-2,3-dihydroindole-1-carboxylic acid (phenylmethyl) ester; 2-(N-[(2-methylpropan-2-yl)oxy-oxomethyl]anilino)acetic acid IUPAC Name: benzyl 6-carbamoyl-2,3-dihydroindole-1-carboxylate; 2-[N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]acetic acid Traditional Name: 2-(N-tert-butoxycarbonylanilino)acetic acid; 6-carbamoylindoline-1-carboxylic acid benzyl ester Formula: C30H33N3O7 MolecularWeight: 547.59892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC(=O)O)C1=CC=CC=C1.C1CN(C2=C1C=CC(=C2)C(=O)N)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(CC(=O)O)C1=CC=CC=C1.C1CN(C2=C1C=CC(=C2)C(=O)N)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C17H16N2O3.C13H17NO4/c18-16(20)14-7-6-13-8-9-19(15(13)10-14)17(21)22-11-12-4-2-1-3-5-12;1-13(2,3)18-12(17)14(9-11(15)16)10-7-5-4-6-8-10/h1-7,10H,8-9,11H2,(H2,18,20);4-8H,9H2,1-3H3,(H,15,16)