O3-methyl O6-(phenylmethyl) 5-azanyl-4-ethyl-2-methoxy-1-piperidin-4-yl-indole-3,6-dicarboxylate

Systemtic Name: O3-methyl O6-(phenylmethyl) 5-azanyl-4-ethyl-2-methoxy-1-piperidin-4-yl-indole-3,6-dicarboxylate Openeye Name: O6-benzyl O3-methyl 5-amino-4-ethyl-2-methoxy-1-(4-piperidyl)indole-3,6-dicarboxylate CAS Name: 5-amino-4-ethyl-2-methoxy-1-(4-piperidinyl)indole-3,6-dicarboxylic acid O3-methyl ester O6-(phenylmethyl) ester IUPAC Name: 6-O-benzyl 3-O-methyl 5-amino-4-ethyl-2-methoxy-1-piperidin-4-ylindole-3,6-dicarboxylate Traditional Name: 5-amino-4-ethyl-2-methoxy-1-(4-piperidyl)indole-3,6-dicarboxylic acid O6-benzyl ester O3-methyl ester Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC2=C1C(=C(N2C3CCNCC3)OC)C(=O)OC)C(=O)OCC4=CC=CC=C4)N

Isomeric SMILES

CCC1=C(C(=CC2=C1C(=C(N2C3CCNCC3)OC)C(=O)OC)C(=O)OCC4=CC=CC=C4)N

InChI

InChI=1S/C26H31N3O5/c1-4-18-21-20(14-19(23(18)27)25(30)34-15-16-8-6-5-7-9-16)29(17-10-12-28-13-11-17)24(32-2)22(21)26(31)33-3/h5-9,14,17,28H,4,10-13,15,27H2,1-3H3