N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(9,10-dioxo-1-anthryl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(9,10-dioxo-1-anthracenyl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(9,10-dioxoanthracen-1-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(9,10-diketo-1-anthryl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C22H23N2O3+ MolecularWeight: 363.42962

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H22N2O3/c1-14-6-5-11-24(12-14)13-19(25)23-18-10-4-9-17-20(18)22(27)16-8-3-2-7-15(16)21(17)26/h2-4,7-10,14H,5-6,11-13H2,1H3,(H,23,25)/p+1/t14-/m0/s1