2-[5-aminocarbonyl-9-[(4-cyanophenyl)methyl]carbazol-4-yl]oxy-3-methoxy-propanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(4-cyanophenyl)methyl]carbazol-4-yl]oxy-3-methoxy-propanoic acid Openeye Name: 2-[5-carbamoyl-9-[(4-cyanophenyl)methyl]carbazol-4-yl]oxy-3-methoxy-propanoic acid CAS Name: 2-[[5-carbamoyl-9-[(4-cyanophenyl)methyl]-4-carbazolyl]oxy]-3-methoxypropanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(4-cyanophenyl)methyl]carbazol-4-yl]oxy-3-methoxypropanoic acid Traditional Name: 2-[5-carbamoyl-9-(4-cyanobenzyl)carbazol-4-yl]oxy-3-methoxy-propionic acid Formula: C25H21N3O5 MolecularWeight: 443.45134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=C(C=C4)C#N)C(=O)N

Isomeric SMILES

COCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=C(C=C4)C#N)C(=O)N

InChI

InChI=1S/C25H21N3O5/c1-32-14-21(25(30)31)33-20-7-3-6-19-23(20)22-17(24(27)29)4-2-5-18(22)28(19)13-16-10-8-15(12-26)9-11-16/h2-11,21H,13-14H2,1H3,(H2,27,29)(H,30,31)