4-azanyl-2-[6-azanyl-7-[(2-methylpropan-2-yl)oxy]-7-oxidanylidene-heptanoyl]benzoic acid

Systemtic Name: 4-azanyl-2-[6-azanyl-7-[(2-methylpropan-2-yl)oxy]-7-oxidanylidene-heptanoyl]benzoic acid Openeye Name: 4-amino-2-(6-amino-7-tert-butoxy-7-oxo-heptanoyl)benzoic acid CAS Name: 4-amino-2-[6-amino-7-[(2-methylpropan-2-yl)oxy]-1,7-dioxoheptyl]benzoic acid IUPAC Name: 4-amino-2-[6-amino-7-[(2-methylpropan-2-yl)oxy]-7-oxoheptanoyl]benzoic acid Traditional Name: 4-amino-2-(6-amino-7-tert-butoxy-7-keto-heptanoyl)benzoic acid Formula: C18H26N2O5 MolecularWeight: 350.40944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCCC(=O)C1=C(C=CC(=C1)N)C(=O)O)N

Isomeric SMILES

CC(C)(C)OC(=O)C(CCCCC(=O)C1=C(C=CC(=C1)N)C(=O)O)N

InChI

InChI=1S/C18H26N2O5/c1-18(2,3)25-17(24)14(20)6-4-5-7-15(21)13-10-11(19)8-9-12(13)16(22)23/h8-10,14H,4-7,19-20H2,1-3H3,(H,22,23)