3-(azepan-1-ium-1-ylmethyl)-2-methyl-6-morpholin-4-yl-1H-quinolin-4-one

Systemtic Name: 3-(azepan-1-ium-1-ylmethyl)-2-methyl-6-morpholin-4-yl-1H-quinolin-4-one Openeye Name: 3-(azepan-1-ium-1-ylmethyl)-2-methyl-6-morpholino-1H-quinolin-4-one CAS Name: 3-(1-azepan-1-iumylmethyl)-2-methyl-6-(4-morpholinyl)-1H-quinolin-4-one IUPAC Name: 3-(azepan-1-ium-1-ylmethyl)-2-methyl-6-morpholin-4-yl-1H-quinolin-4-one Traditional Name: 3-(azepan-1-ium-1-ylmethyl)-2-methyl-6-morpholino-4-quinolone Formula: C21H30N3O2+ MolecularWeight: 356.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C=CC(=C2)N3CCOCC3)C[NH+]4CCCCCC4

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=CC(=C2)N3CCOCC3)C[NH+]4CCCCCC4

InChI

InChI=1S/C21H29N3O2/c1-16-19(15-23-8-4-2-3-5-9-23)21(25)18-14-17(6-7-20(18)22-16)24-10-12-26-13-11-24/h6-7,14H,2-5,8-13,15H2,1H3,(H,22,25)/p+1