N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]-2-oxo-chromene-3-carboxamide CAS Name: N-[2-[4-(3-methylphenyl)-1-piperazin-1-iumyl]ethyl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-2-oxochromene-3-carboxamide Traditional Name: 2-keto-N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]chromene-3-carboxamide Formula: C23H26N3O3+ MolecularWeight: 392.47084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C23H25N3O3/c1-17-5-4-7-19(15-17)26-13-11-25(12-14-26)10-9-24-22(27)20-16-18-6-2-3-8-21(18)29-23(20)28/h2-8,15-16H,9-14H2,1H3,(H,24,27)/p+1