methyl 3-[(phenoxysulfonylamino)methyl]-1-[2-(phenylmethyl)pentyl]indole-5-carboxylate

Systemtic Name: methyl 3-[(phenoxysulfonylamino)methyl]-1-[2-(phenylmethyl)pentyl]indole-5-carboxylate Openeye Name: methyl 1-(2-benzylpentyl)-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate CAS Name: 3-[(phenoxysulfonylamino)methyl]-1-[2-(phenylmethyl)pentyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-benzylpentyl)-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate Traditional Name: 1-(2-benzylpentyl)-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylic acid methyl ester Formula: C29H32N2O5S MolecularWeight: 520.63978

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNS(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CCCC(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNS(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C29H32N2O5S/c1-3-10-23(17-22-11-6-4-7-12-22)20-31-21-25(27-18-24(29(32)35-2)15-16-28(27)31)19-30-37(33,34)36-26-13-8-5-9-14-26/h4-9,11-16,18,21,23,30H,3,10,17,19-20H2,1-2H3