[1-oxidanylidene-1-(pyridin-3-ylamino)butan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate

Systemtic Name: [1-oxidanylidene-1-(pyridin-3-ylamino)butan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate Openeye Name: 1-(3-pyridylcarbamoyl)propyl 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate CAS Name: 8-(1,3-benzoxazol-2-yl)-1-naphthalenecarboxylic acid [1-oxo-1-(3-pyridinylamino)butan-2-yl] ester IUPAC Name: [1-oxo-1-(pyridin-3-ylamino)butan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate Traditional Name: 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylic acid 1-(3-pyridylcarbamoyl)propyl ester Formula: C27H21N3O4 MolecularWeight: 451.47334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CN=CC=C1)OC(=O)C2=CC=CC3=C2C(=CC=C3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CCC(C(=O)NC1=CN=CC=C1)OC(=O)C2=CC=CC3=C2C(=CC=C3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C27H21N3O4/c1-2-22(25(31)29-18-10-7-15-28-16-18)34-27(32)20-12-6-9-17-8-5-11-19(24(17)20)26-30-21-13-3-4-14-23(21)33-26/h3-16,22H,2H2,1H3,(H,29,31)