1-[6-(hydroxymethyl)indol-1-yl]-4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde

Systemtic Name: 1-[6-(hydroxymethyl)indol-1-yl]-4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde Openeye Name: 1-[6-(hydroxymethyl)indol-1-yl]-4-[3-(isopropylamino)-2-pyridyl]piperazine-2-carbaldehyde CAS Name: 1-[6-(hydroxymethyl)-1-indolyl]-4-[3-(propan-2-ylamino)-2-pyridinyl]-2-piperazinecarboxaldehyde IUPAC Name: 1-[6-(hydroxymethyl)indol-1-yl]-4-[3-(propan-2-ylamino)pyridin-2-yl]piperazine-2-carbaldehyde Traditional Name: 4-[3-(isopropylamino)-2-pyridyl]-1-(6-methylolindol-1-yl)piperazine-2-carbaldehyde Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=C3C=C(C=C4)CO

Isomeric SMILES

CC(C)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=C3C=C(C=C4)CO

InChI

InChI=1S/C22H27N5O2/c1-16(2)24-20-4-3-8-23-22(20)25-10-11-26(19(13-25)15-29)27-9-7-18-6-5-17(14-28)12-21(18)27/h3-9,12,15-16,19,24,28H,10-11,13-14H2,1-2H3