[3-butyl-4-(pyridin-3-ylmethyl)piperazin-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [3-butyl-4-(pyridin-3-ylmethyl)piperazin-1-yl]-naphthalen-1-yl-methanone Openeye Name: [3-butyl-4-(3-pyridylmethyl)piperazin-1-yl]-(1-naphthyl)methanone CAS Name: [3-butyl-4-(3-pyridinylmethyl)-1-piperazinyl]-(1-naphthalenyl)methanone IUPAC Name: [3-butyl-4-(pyridin-3-ylmethyl)piperazin-1-yl]-naphthalen-1-ylmethanone Traditional Name: [3-butyl-4-(3-pyridylmethyl)piperazino]-(1-naphthyl)methanone Formula: C25H29N3O MolecularWeight: 387.51726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1CC2=CN=CC=C2)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCC1CN(CCN1CC2=CN=CC=C2)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H29N3O/c1-2-3-11-22-19-28(16-15-27(22)18-20-8-7-14-26-17-20)25(29)24-13-6-10-21-9-4-5-12-23(21)24/h4-10,12-14,17,22H,2-3,11,15-16,18-19H2,1H3