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

Systemtic Name: 2-methyl-7-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propylamino]-13-oxidanyl-naphtho[3,2-a]phenoxazin-14-ium-8-one Openeye Name: 13-hydroxy-2-methyl-7-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propylamino]naphtho[3,2-a]phenoxazin-14-ium-8-one CAS Name: 13-hydroxy-2-methyl-7-[3-[(3S)-3-methyl-1-piperidin-1-iumyl]propylamino]-8-naphtho[3,2-a]phenoxazin-14-iumone IUPAC Name: 13-hydroxy-2-methyl-7-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propylamino]naphtho[3,2-a]phenoxazin-14-ium-8-one Traditional Name: 13-hydroxy-2-methyl-7-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propylamino]naphtho[3,2-a]phenoxazin-14-ium-8-one Formula: C30H33N3O3+2 MolecularWeight: 483.60132

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCNC2=C3C(=C(C4=CC=CC=C4C3=O)O)C5=[NH+]C6=C(C=CC(=C6)C)OC5=C2

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCCNC2=C3C(=C(C4=CC=CC=C4C3=O)O)C5=[NH+]C6=C(C=CC(=C6)C)OC5=C2

InChI

InChI=1S/C30H31N3O3/c1-18-10-11-24-22(15-18)32-28-25(36-24)16-23(31-12-6-14-33-13-5-7-19(2)17-33)26-27(28)30(35)21-9-4-3-8-20(21)29(26)34/h3-4,8-11,15-16,19,31,35H,5-7,12-14,17H2,1-2H3/p+2/t19-/m0/s1