ethanedioic acid; N-[3-oxidanyl-4-[4-(2-propoxyphenyl)piperazin-1-yl]butyl]-1H-indole-2-carboxamide

Systemtic Name: ethanedioic acid; N-[3-oxidanyl-4-[4-(2-propoxyphenyl)piperazin-1-yl]butyl]-1H-indole-2-carboxamide Openeye Name: N-[3-hydroxy-4-[4-(2-propoxyphenyl)piperazin-1-yl]butyl]-1H-indole-2-carboxamide; oxalic acid CAS Name: N-[3-hydroxy-4-[4-(2-propoxyphenyl)-1-piperazinyl]butyl]-1H-indole-2-carboxamide; oxalic acid IUPAC Name: N-[3-hydroxy-4-[4-(2-propoxyphenyl)piperazin-1-yl]butyl]-1H-indole-2-carboxamide; oxalic acid Traditional Name: N-[3-hydroxy-4-[4-(2-propoxyphenyl)piperazino]butyl]-1H-indole-2-carboxamide; oxalic acid Formula: C30H38N4O11 MolecularWeight: 630.64292

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1N2CCN(CC2)CC(CCNC(=O)C3=CC4=CC=CC=C4N3)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCCOC1=CC=CC=C1N2CCN(CC2)CC(CCNC(=O)C3=CC4=CC=CC=C4N3)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C26H34N4O3.2C2H2O4/c1-2-17-33-25-10-6-5-9-24(25)30-15-13-29(14-16-30)19-21(31)11-12-27-26(32)23-18-20-7-3-4-8-22(20)28-23;2*3-1(4)2(5)6/h3-10,18,21,28,31H,2,11-17,19H2,1H3,(H,27,32);2*(H,3,4)(H,5,6)