ethyl 4-[(1Z)-3-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-1-(phenylmethylidene)inden-5-yl]oxybutanoate

Systemtic Name: ethyl 4-[(1Z)-3-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-1-(phenylmethylidene)inden-5-yl]oxybutanoate Openeye Name: ethyl 4-[(1Z)-3-(2-amino-2-oxo-ethyl)-1-benzylidene-2-methyl-inden-5-yl]oxybutanoate CAS Name: 4-[[(1Z)-3-(2-amino-2-oxoethyl)-2-methyl-1-(phenylmethylene)-5-indenyl]oxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(1Z)-3-(2-amino-2-oxoethyl)-1-benzylidene-2-methylinden-5-yl]oxybutanoate Traditional Name: 4-[(1Z)-3-(2-amino-2-keto-ethyl)-1-benzal-2-methyl-inden-5-yl]oxybutyric acid ethyl ester Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=CC2=C(C=C1)C(=CC3=CC=CC=C3)C(=C2CC(=O)N)C

Isomeric SMILES

CCOC(=O)CCCOC1=CC2=C(C=C1)/C(=C\C3=CC=CC=C3)/C(=C2CC(=O)N)C

InChI

InChI=1S/C25H27NO4/c1-3-29-25(28)10-7-13-30-19-11-12-20-21(14-18-8-5-4-6-9-18)17(2)22(16-24(26)27)23(20)15-19/h4-6,8-9,11-12,14-15H,3,7,10,13,16H2,1-2H3,(H2,26,27)/b21-14-