piperidin-1-yl-[4-[(4-propan-2-ylpiperazin-1-yl)methyl]-3-pyridin-3-yloxy-phenyl]methanone

Systemtic Name: piperidin-1-yl-[4-[(4-propan-2-ylpiperazin-1-yl)methyl]-3-pyridin-3-yloxy-phenyl]methanone Openeye Name: [4-[(4-isopropylpiperazin-1-yl)methyl]-3-(3-pyridyloxy)phenyl]-(1-piperidyl)methanone CAS Name: 1-piperidinyl-[4-[(4-propan-2-yl-1-piperazinyl)methyl]-3-(3-pyridinyloxy)phenyl]methanone IUPAC Name: piperidin-1-yl-[4-[(4-propan-2-ylpiperazin-1-yl)methyl]-3-pyridin-3-yloxyphenyl]methanone Traditional Name: [4-[(4-isopropylpiperazino)methyl]-3-(3-pyridyloxy)phenyl]-piperidino-methanone Formula: C25H34N4O2 MolecularWeight: 422.56306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)CC2=C(C=C(C=C2)C(=O)N3CCCCC3)OC4=CN=CC=C4

Isomeric SMILES

CC(C)N1CCN(CC1)CC2=C(C=C(C=C2)C(=O)N3CCCCC3)OC4=CN=CC=C4

InChI

InChI=1S/C25H34N4O2/c1-20(2)28-15-13-27(14-16-28)19-22-9-8-21(25(30)29-11-4-3-5-12-29)17-24(22)31-23-7-6-10-26-18-23/h6-10,17-18,20H,3-5,11-16,19H2,1-2H3