(phenylmethyl) 3-[(2-methoxy-4-methoxycarbonyl-phenyl)methyl]-1-propyl-indole-5-carboxylate

Systemtic Name: (phenylmethyl) 3-[(2-methoxy-4-methoxycarbonyl-phenyl)methyl]-1-propyl-indole-5-carboxylate Openeye Name: benzyl 3-[(2-methoxy-4-methoxycarbonyl-phenyl)methyl]-1-propyl-indole-5-carboxylate CAS Name: 3-[(2-methoxy-4-methoxycarbonylphenyl)methyl]-1-propyl-5-indolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[(2-methoxy-4-methoxycarbonylphenyl)methyl]-1-propylindole-5-carboxylate Traditional Name: 3-(4-carbomethoxy-2-methoxy-benzyl)-1-propyl-indole-5-carboxylic acid benzyl ester Formula: C29H29NO5 MolecularWeight: 471.54426

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=C1C=CC(=C2)C(=O)OCC3=CC=CC=C3)CC4=C(C=C(C=C4)C(=O)OC)OC

Isomeric SMILES

CCCN1C=C(C2=C1C=CC(=C2)C(=O)OCC3=CC=CC=C3)CC4=C(C=C(C=C4)C(=O)OC)OC

InChI

InChI=1S/C29H29NO5/c1-4-14-30-18-24(15-21-10-11-23(28(31)34-3)17-27(21)33-2)25-16-22(12-13-26(25)30)29(32)35-19-20-8-6-5-7-9-20/h5-13,16-18H,4,14-15,19H2,1-3H3