2-methyl-7-[2-(4-methylpiperidin-1-ium-1-yl)ethylamino]-13-oxidanyl-naphtho[3,2-a]phenoxazin-14-ium-8-one

Systemtic Name: 2-methyl-7-[2-(4-methylpiperidin-1-ium-1-yl)ethylamino]-13-oxidanyl-naphtho[3,2-a]phenoxazin-14-ium-8-one Openeye Name: 13-hydroxy-2-methyl-7-[2-(4-methylpiperidin-1-ium-1-yl)ethylamino]naphtho[3,2-a]phenoxazin-14-ium-8-one CAS Name: 13-hydroxy-2-methyl-7-[2-(4-methyl-1-piperidin-1-iumyl)ethylamino]-8-naphtho[3,2-a]phenoxazin-14-iumone IUPAC Name: 13-hydroxy-2-methyl-7-[2-(4-methylpiperidin-1-ium-1-yl)ethylamino]naphtho[3,2-a]phenoxazin-14-ium-8-one Traditional Name: 13-hydroxy-2-methyl-7-[2-(4-methylpiperidin-1-ium-1-yl)ethylamino]naphtho[3,2-a]phenoxazin-14-ium-8-one Formula: C29H31N3O3+2 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCNC2=C3C(=C(C4=CC=CC=C4C3=O)O)C5=[NH+]C6=C(C=CC(=C6)C)OC5=C2

Isomeric SMILES

CC1CC[NH+](CC1)CCNC2=C3C(=C(C4=CC=CC=C4C3=O)O)C5=[NH+]C6=C(C=CC(=C6)C)OC5=C2

InChI

InChI=1S/C29H29N3O3/c1-17-9-12-32(13-10-17)14-11-30-22-16-24-27(31-21-15-18(2)7-8-23(21)35-24)26-25(22)28(33)19-5-3-4-6-20(19)29(26)34/h3-8,15-17,30,34H,9-14H2,1-2H3/p+2