2-(4-methylpiperidin-1-yl)-N-[6-[2-(4-methylpiperidin-1-yl)propanoylamino]acridin-3-yl]propanamide hydrate

Systemtic Name: 2-(4-methylpiperidin-1-yl)-N-[6-[2-(4-methylpiperidin-1-yl)propanoylamino]acridin-3-yl]propanamide hydrate Openeye Name: 2-(4-methyl-1-piperidyl)-N-[6-[2-(4-methyl-1-piperidyl)propanoylamino]acridin-3-yl]propanamide hydrate CAS Name: 2-(4-methyl-1-piperidinyl)-N-[6-[[2-(4-methyl-1-piperidinyl)-1-oxopropyl]amino]-3-acridinyl]propanamide hydrate IUPAC Name: 2-(4-methylpiperidin-1-yl)-N-[6-[2-(4-methylpiperidin-1-yl)propanoylamino]acridin-3-yl]propanamide hydrate Traditional Name: 2-(4-methylpiperidino)-N-[6-[2-(4-methylpiperidino)propanoylamino]acridin-3-yl]propionamide hydrate Formula: C31H43N5O3 MolecularWeight: 533.70482

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(C)C(=O)NC2=CC3=C(C=C2)C=C4C=CC(=CC4=N3)NC(=O)C(C)N5CCC(CC5)C.O

Isomeric SMILES

CC1CCN(CC1)C(C)C(=O)NC2=CC3=C(C=C2)C=C4C=CC(=CC4=N3)NC(=O)C(C)N5CCC(CC5)C.O

InChI

InChI=1S/C31H41N5O2.H2O/c1-20-9-13-35(14-10-20)22(3)30(37)32-26-7-5-24-17-25-6-8-27(19-29(25)34-28(24)18-26)33-31(38)23(4)36-15-11-21(2)12-16-36;/h5-8,17-23H,9-16H2,1-4H3,(H,32,37)(H,33,38);1H2