2-methyl-2-[1-[(3-nitrophenyl)methyl]piperidin-4-yl]-3,3a,4,5-tetrahydroacenaphthylen-1-one

Systemtic Name: 2-methyl-2-[1-[(3-nitrophenyl)methyl]piperidin-4-yl]-3,3a,4,5-tetrahydroacenaphthylen-1-one Openeye Name: 2-methyl-2-[1-[(3-nitrophenyl)methyl]-4-piperidyl]-3,3a,4,5-tetrahydroacenaphthylen-1-one CAS Name: 2-methyl-2-[1-[(3-nitrophenyl)methyl]-4-piperidinyl]-3,3a,4,5-tetrahydroacenaphthylen-1-one IUPAC Name: 2-methyl-2-[1-[(3-nitrophenyl)methyl]piperidin-4-yl]-3,3a,4,5-tetrahydroacenaphthylen-1-one Traditional Name: 2-methyl-2-[1-(3-nitrobenzyl)-4-piperidyl]-3,3a,4,5-tetrahydroacenaphthylen-1-one Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCCC3=CC=CC(=C23)C1=O)C4CCN(CC4)CC5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1(C2CCCC3=CC=CC(=C23)C1=O)C4CCN(CC4)CC5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H28N2O3/c1-25(22-10-4-7-18-6-3-9-21(23(18)22)24(25)28)19-11-13-26(14-12-19)16-17-5-2-8-20(15-17)27(29)30/h2-3,5-6,8-9,15,19,22H,4,7,10-14,16H2,1H3