ethyl 5-(2-azanyl-5-methoxy-phenyl)carbonyl-2-butanoyl-3,4-dihydropyrazole-3-carboxylate

Systemtic Name: ethyl 5-(2-azanyl-5-methoxy-phenyl)carbonyl-2-butanoyl-3,4-dihydropyrazole-3-carboxylate Openeye Name: ethyl 5-(2-amino-5-methoxy-benzoyl)-2-butanoyl-3,4-dihydropyrazole-3-carboxylate CAS Name: 5-[(2-amino-5-methoxyphenyl)-oxomethyl]-2-(1-oxobutyl)-3,4-dihydropyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-amino-5-methoxybenzoyl)-2-butanoyl-3,4-dihydropyrazole-3-carboxylate Traditional Name: 5-(2-amino-5-methoxy-benzoyl)-2-butyryl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(CC(=N1)C(=O)C2=C(C=CC(=C2)OC)N)C(=O)OCC

Isomeric SMILES

CCCC(=O)N1C(CC(=N1)C(=O)C2=C(C=CC(=C2)OC)N)C(=O)OCC

InChI

InChI=1S/C18H23N3O5/c1-4-6-16(22)21-15(18(24)26-5-2)10-14(20-21)17(23)12-9-11(25-3)7-8-13(12)19/h7-9,15H,4-6,10,19H2,1-3H3