2-(4-oxidanylpiperidin-1-yl)-N-[6-[2-(4-oxidanylpiperidin-1-yl)ethanoylamino]acridin-3-yl]ethanamide hydrate

Systemtic Name: 2-(4-oxidanylpiperidin-1-yl)-N-[6-[2-(4-oxidanylpiperidin-1-yl)ethanoylamino]acridin-3-yl]ethanamide hydrate Openeye Name: 2-(4-hydroxy-1-piperidyl)-N-[6-[[2-(4-hydroxy-1-piperidyl)acetyl]amino]acridin-3-yl]acetamide hydrate CAS Name: 2-(4-hydroxy-1-piperidinyl)-N-[6-[[2-(4-hydroxy-1-piperidinyl)-1-oxoethyl]amino]-3-acridinyl]acetamide hydrate IUPAC Name: 2-(4-hydroxypiperidin-1-yl)-N-[6-[[2-(4-hydroxypiperidin-1-yl)acetyl]amino]acridin-3-yl]acetamide hydrate Traditional Name: 2-(4-hydroxypiperidino)-N-[6-[[2-(4-hydroxypiperidino)acetyl]amino]acridin-3-yl]acetamide hydrate Formula: C27H35N5O5 MolecularWeight: 509.5973

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)CC(=O)NC2=CC3=C(C=C2)C=C4C=CC(=CC4=N3)NC(=O)CN5CCC(CC5)O.O

Isomeric SMILES

C1CN(CCC1O)CC(=O)NC2=CC3=C(C=C2)C=C4C=CC(=CC4=N3)NC(=O)CN5CCC(CC5)O.O

InChI

InChI=1S/C27H33N5O4.H2O/c33-22-5-9-31(10-6-22)16-26(35)28-20-3-1-18-13-19-2-4-21(15-25(19)30-24(18)14-20)29-27(36)17-32-11-7-23(34)8-12-32;/h1-4,13-15,22-23,33-34H,5-12,16-17H2,(H,28,35)(H,29,36);1H2