7-[(1-azanyl-2,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]-3,4-dihydro-1H-isochromene-6-carboxylic acid

Systemtic Name: 7-[(1-azanyl-2,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]-3,4-dihydro-1H-isochromene-6-carboxylic acid Openeye Name: 7-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]isochromane-6-carboxylic acid CAS Name: 7-[[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)amino]-oxomethyl]-3,4-dihydro-1H-2-benzopyran-6-carboxylic acid IUPAC Name: 7-[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)carbamoyl]-3,4-dihydro-1H-isochromene-6-carboxylic acid Traditional Name: 7-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]isochroman-6-carboxylic acid Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C(=O)N)NC(=O)C1=CC2=C(CCOC2)C=C1C(=O)O

Isomeric SMILES

CC(C)C(C)(C(=O)N)NC(=O)C1=CC2=C(CCOC2)C=C1C(=O)O

InChI

InChI=1S/C17H22N2O5/c1-9(2)17(3,16(18)23)19-14(20)12-7-11-8-24-5-4-10(11)6-13(12)15(21)22/h6-7,9H,4-5,8H2,1-3H3,(H2,18,23)(H,19,20)(H,21,22)