6-chloranyl-7-methyl-4-oxidanylidene-N-[(2R)-2-piperidin-1-ium-1-yl-2-(4-propan-2-ylphenyl)ethyl]chromene-2-carboxamide

Systemtic Name: 6-chloranyl-7-methyl-4-oxidanylidene-N-[(2R)-2-piperidin-1-ium-1-yl-2-(4-propan-2-ylphenyl)ethyl]chromene-2-carboxamide Openeye Name: 6-chloro-N-[(2R)-2-(4-isopropylphenyl)-2-piperidin-1-ium-1-yl-ethyl]-7-methyl-4-oxo-chromene-2-carboxamide CAS Name: 6-chloro-7-methyl-4-oxo-N-[(2R)-2-(1-piperidin-1-iumyl)-2-(4-propan-2-ylphenyl)ethyl]-1-benzopyran-2-carboxamide IUPAC Name: 6-chloro-7-methyl-4-oxo-N-[(2R)-2-piperidin-1-ium-1-yl-2-(4-propan-2-ylphenyl)ethyl]chromene-2-carboxamide Traditional Name: 6-chloro-4-keto-7-methyl-N-[(2R)-2-p-cumenyl-2-piperidin-1-ium-1-yl-ethyl]chromene-2-carboxamide Formula: C27H32ClN2O3+ MolecularWeight: 468.00758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=CC2=O)C(=O)NCC(C3=CC=C(C=C3)C(C)C)[NH+]4CCCCC4)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=CC2=O)C(=O)NC[C@@H](C3=CC=C(C=C3)C(C)C)[NH+]4CCCCC4)Cl

InChI

InChI=1S/C27H31ClN2O3/c1-17(2)19-7-9-20(10-8-19)23(30-11-5-4-6-12-30)16-29-27(32)26-15-24(31)21-14-22(28)18(3)13-25(21)33-26/h7-10,13-15,17,23H,4-6,11-12,16H2,1-3H3,(H,29,32)/p+1/t23-/m0/s1