N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]propionamide Formula: C20H30N3O3+ MolecularWeight: 360.4705

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)CCN2C(=O)COC3=CC=CC=C32

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)CCN2C(=O)COC3=CC=CC=C32

InChI

InChI=1S/C20H29N3O3/c1-16-7-12-22(13-8-16)11-4-10-21-19(24)9-14-23-17-5-2-3-6-18(17)26-15-20(23)25/h2-3,5-6,16H,4,7-15H2,1H3,(H,21,24)/p+1