3-(1,5-dimethylindol-3-yl)-2-(phenylmethoxycarbonylamino)butanoic acid; methoxymethane

Systemtic Name: 3-(1,5-dimethylindol-3-yl)-2-(phenylmethoxycarbonylamino)butanoic acid; methoxymethane Openeye Name: 2-(benzyloxycarbonylamino)-3-(1,5-dimethylindol-3-yl)butanoic acid; methoxymethane CAS Name: 3-(1,5-dimethyl-3-indolyl)-2-(phenylmethoxycarbonylamino)butanoic acid; methoxymethane IUPAC Name: 3-(1,5-dimethylindol-3-yl)-2-(phenylmethoxycarbonylamino)butanoic acid; methoxymethane Traditional Name: 2-(benzyloxycarbonylamino)-3-(1,5-dimethylindol-3-yl)butyric acid; methoxymethane Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C=C2C(C)C(C(=O)O)NC(=O)OCC3=CC=CC=C3)C.COC

Isomeric SMILES

CC1=CC2=C(C=C1)N(C=C2C(C)C(C(=O)O)NC(=O)OCC3=CC=CC=C3)C.COC

InChI

InChI=1S/C22H24N2O4.C2H6O/c1-14-9-10-19-17(11-14)18(12-24(19)3)15(2)20(21(25)26)23-22(27)28-13-16-7-5-4-6-8-16;1-3-2/h4-12,15,20H,13H2,1-3H3,(H,23,27)(H,25,26);1-2H3