1-phenylpiperazine; 3-[4-(4-phenylpiperazin-1-yl)butyl]-1H-indole-5-carboxylic acid

Systemtic Name: 1-phenylpiperazine; 3-[4-(4-phenylpiperazin-1-yl)butyl]-1H-indole-5-carboxylic acid Openeye Name: 1-phenylpiperazine; 3-[4-(4-phenylpiperazin-1-yl)butyl]-1H-indole-5-carboxylic acid CAS Name: 1-phenylpiperazine; 3-[4-(4-phenyl-1-piperazinyl)butyl]-1H-indole-5-carboxylic acid IUPAC Name: 1-phenylpiperazine; 3-[4-(4-phenylpiperazin-1-yl)butyl]-1H-indole-5-carboxylic acid Traditional Name: 1-phenylpiperazine; 3-[4-(4-phenylpiperazino)butyl]-1H-indole-5-carboxylic acid Formula: C33H41N5O2 MolecularWeight: 539.71094

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC=C2.C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1)C2=CC=CC=C2.C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O2.C10H14N2/c27-23(28)18-9-10-22-21(16-18)19(17-24-22)6-4-5-11-25-12-14-26(15-13-25)20-7-2-1-3-8-20;1-2-4-10(5-3-1)12-8-6-11-7-9-12/h1-3,7-10,16-17,24H,4-6,11-15H2,(H,27,28);1-5,11H,6-9H2