3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 3-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[2-keto-2-[4-(4-methoxyphenyl)piperazino]ethyl]-1H-indole-2-carboxylic acid Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC3=C(NC4=CC=CC=C43)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC3=C(NC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C22H23N3O4/c1-29-16-8-6-15(7-9-16)24-10-12-25(13-11-24)20(26)14-18-17-4-2-3-5-19(17)23-21(18)22(27)28/h2-9,23H,10-14H2,1H3,(H,27,28)