2-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-3-methyl-1,4-dihydrophthalazine-1-carboxylic acid

Systemtic Name: 2-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-3-methyl-1,4-dihydrophthalazine-1-carboxylic acid Openeye Name: 2-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]-3-methyl-1,4-dihydrophthalazine-1-carboxylic acid CAS Name: 2-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-3-methyl-1,4-dihydrophthalazine-1-carboxylic acid IUPAC Name: 2-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]-3-methyl-1,4-dihydrophthalazine-1-carboxylic acid Traditional Name: 2-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl]-3-methyl-1,4-dihydrophthalazine-1-carboxylic acid Formula: C25H31N3O5 MolecularWeight: 453.53074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2C(C3=CC=CC=C3CN2C)C(=O)O

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2C(C3=CC=CC=C3CN2C)C(=O)O

InChI

InChI=1S/C25H31N3O5/c1-4-33-25(32)21(15-14-18-10-6-5-7-11-18)26-17(2)23(29)28-22(24(30)31)20-13-9-8-12-19(20)16-27(28)3/h5-13,17,21-22,26H,4,14-16H2,1-3H3,(H,30,31)