4-methyl-2-[4-[4-(7-oxidanylnaphthalen-1-yl)piperazin-1-yl]butyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 4-methyl-2-[4-[4-(7-oxidanylnaphthalen-1-yl)piperazin-1-yl]butyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[4-[4-(7-hydroxy-1-naphthyl)piperazin-1-yl]butyl]-4-methyl-1,2,4-triazine-3,5-dione CAS Name: 2-[4-[4-(7-hydroxy-1-naphthalenyl)-1-piperazinyl]butyl]-4-methyl-1,2,4-triazine-3,5-dione IUPAC Name: 2-[4-[4-(7-hydroxynaphthalen-1-yl)piperazin-1-yl]butyl]-4-methyl-1,2,4-triazine-3,5-dione Traditional Name: 2-[4-[4-(7-hydroxy-1-naphthyl)piperazino]butyl]-4-methyl-1,2,4-triazine-3,5-quinone Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=NN(C1=O)CCCCN2CCN(CC2)C3=CC=CC4=C3C=C(C=C4)O

Isomeric SMILES

CN1C(=O)C=NN(C1=O)CCCCN2CCN(CC2)C3=CC=CC4=C3C=C(C=C4)O

InChI

InChI=1S/C22H27N5O3/c1-24-21(29)16-23-27(22(24)30)10-3-2-9-25-11-13-26(14-12-25)20-6-4-5-17-7-8-18(28)15-19(17)20/h4-8,15-16,28H,2-3,9-14H2,1H3