4-(morpholin-4-ium-4-ylmethyl)-6-propan-2-yl-chromen-2-one

Systemtic Name: 4-(morpholin-4-ium-4-ylmethyl)-6-propan-2-yl-chromen-2-one Openeye Name: 6-isopropyl-4-(morpholin-4-ium-4-ylmethyl)chromen-2-one CAS Name: 4-(4-morpholin-4-iumylmethyl)-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 4-(morpholin-4-ium-4-ylmethyl)-6-propan-2-ylchromen-2-one Traditional Name: 6-isopropyl-4-(morpholin-4-ium-4-ylmethyl)coumarin Formula: C17H22NO3+ MolecularWeight: 288.36148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)OC(=O)C=C2C[NH+]3CCOCC3

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)OC(=O)C=C2C[NH+]3CCOCC3

InChI

InChI=1S/C17H21NO3/c1-12(2)13-3-4-16-15(9-13)14(10-17(19)21-16)11-18-5-7-20-8-6-18/h3-4,9-10,12H,5-8,11H2,1-2H3/p+1