ethyl 2-azanyl-4-[2-[(2-cyanophenyl)methoxy]phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[2-[(2-cyanophenyl)methoxy]phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate Openeye Name: ethyl 2-amino-4-[2-[(2-cyanophenyl)methoxy]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate CAS Name: 2-amino-4-[2-[(2-cyanophenyl)methoxy]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[2-[(2-cyanophenyl)methoxy]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate Traditional Name: 2-amino-4-[2-(2-cyanobenzyl)oxyphenyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carboxylic acid ethyl ester Formula: C28H28N2O5 MolecularWeight: 472.53232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC=CC=C3OCC4=CC=CC=C4C#N)C(=O)CC(C2)(C)C)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C1C3=CC=CC=C3OCC4=CC=CC=C4C#N)C(=O)CC(C2)(C)C)N

InChI

InChI=1S/C28H28N2O5/c1-4-33-27(32)25-23(24-20(31)13-28(2,3)14-22(24)35-26(25)30)19-11-7-8-12-21(19)34-16-18-10-6-5-9-17(18)15-29/h5-12,23H,4,13-14,16,30H2,1-3H3