4-[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]butanoate

Systemtic Name: 4-[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]butanoate Openeye Name: 4-[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]butanoate CAS Name: 4-[4-[(2,3-dimethylanilino)-oxomethyl]phenoxy]butanoate IUPAC Name: 4-[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]butanoate Traditional Name: 4-[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]butyrate Formula: C19H20NO4- MolecularWeight: 326.3664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)OCCCC(=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)OCCCC(=O)[O-])C

InChI

InChI=1S/C19H21NO4/c1-13-5-3-6-17(14(13)2)20-19(23)15-8-10-16(11-9-15)24-12-4-7-18(21)22/h3,5-6,8-11H,4,7,12H2,1-2H3,(H,20,23)(H,21,22)/p-1