methyl 3-[2-[[(1S)-1-phenylethyl]-phenylmethoxycarbonyl-amino]ethyl]-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[2-[[(1S)-1-phenylethyl]-phenylmethoxycarbonyl-amino]ethyl]-1H-indole-2-carboxylate Openeye Name: methyl 3-[2-[benzyloxycarbonyl-[(1S)-1-phenylethyl]amino]ethyl]-1H-indole-2-carboxylate CAS Name: 3-[2-[[(1S)-1-phenylethyl]-phenylmethoxycarbonylamino]ethyl]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[2-[[(1S)-1-phenylethyl]-phenylmethoxycarbonylamino]ethyl]-1H-indole-2-carboxylate Traditional Name: 3-[2-[carbobenzoxy-[(1S)-1-phenylethyl]amino]ethyl]-1H-indole-2-carboxylic acid methyl ester Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CCC2=C(NC3=CC=CC=C32)C(=O)OC)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N(CCC2=C(NC3=CC=CC=C32)C(=O)OC)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O4/c1-20(22-13-7-4-8-14-22)30(28(32)34-19-21-11-5-3-6-12-21)18-17-24-23-15-9-10-16-25(23)29-26(24)27(31)33-2/h3-16,20,29H,17-19H2,1-2H3/t20-/m0/s1