[2-(6-methylheptan-2-ylamino)-2-oxidanylidene-ethyl] 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: [2-(6-methylheptan-2-ylamino)-2-oxidanylidene-ethyl] 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: [2-(1,5-dimethylhexylamino)-2-oxo-ethyl] 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid [2-(6-methylheptan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(6-methylheptan-2-ylamino)-2-oxoethyl] 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid [2-(1,5-dimethylhexylamino)-2-keto-ethyl] ester Formula: C18H27ClN2O4 MolecularWeight: 370.87098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)COC(=O)C1=CC(=C(C=C1OC)N)Cl

Isomeric SMILES

CC(C)CCCC(C)NC(=O)COC(=O)C1=CC(=C(C=C1OC)N)Cl

InChI

InChI=1S/C18H27ClN2O4/c1-11(2)6-5-7-12(3)21-17(22)10-25-18(23)13-8-14(19)15(20)9-16(13)24-4/h8-9,11-12H,5-7,10,20H2,1-4H3,(H,21,22)