2-(3-methylpiperidin-1-yl)sulfonyl-3-piperidin-1-yl-naphthalene-1,4-dione

Systemtic Name: 2-(3-methylpiperidin-1-yl)sulfonyl-3-piperidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-[(3-methyl-1-piperidyl)sulfonyl]-3-(1-piperidyl)naphthalene-1,4-dione CAS Name: 2-[(3-methyl-1-piperidinyl)sulfonyl]-3-(1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-(3-methylpiperidin-1-yl)sulfonyl-3-piperidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-(3-methylpiperidino)sulfonyl-3-piperidino-1,4-naphthoquinone Formula: C21H26N2O4S MolecularWeight: 402.50714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCCC4

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCCC4

InChI

InChI=1S/C21H26N2O4S/c1-15-8-7-13-23(14-15)28(26,27)21-18(22-11-5-2-6-12-22)19(24)16-9-3-4-10-17(16)20(21)25/h3-4,9-10,15H,2,5-8,11-14H2,1H3