[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)chromen-2-yl]-2-methyl-propyl]carbamic acid

Systemtic Name: [1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)chromen-2-yl]-2-methyl-propyl]carbamic acid Openeye Name: [1-(3-benzyl-7-chloro-4-oxo-chromen-2-yl)-2-methyl-propyl]carbamic acid CAS Name: [1-[7-chloro-4-oxo-3-(phenylmethyl)-1-benzopyran-2-yl]-2-methylpropyl]carbamic acid IUPAC Name: [1-(3-benzyl-7-chloro-4-oxochromen-2-yl)-2-methylpropyl]carbamic acid Traditional Name: [1-(3-benzyl-7-chloro-4-keto-chromen-2-yl)-2-methyl-propyl]carbamic acid Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=C(C(=O)C2=C(O1)C=C(C=C2)Cl)CC3=CC=CC=C3)NC(=O)O

Isomeric SMILES

CC(C)C(C1=C(C(=O)C2=C(O1)C=C(C=C2)Cl)CC3=CC=CC=C3)NC(=O)O

InChI

InChI=1S/C21H20ClNO4/c1-12(2)18(23-21(25)26)20-16(10-13-6-4-3-5-7-13)19(24)15-9-8-14(22)11-17(15)27-20/h3-9,11-12,18,23H,10H2,1-2H3,(H,25,26)