ethyl 2-[3-aminocarbonyl-4-(3-dodecoxyphenyl)carbonyl-4H-pyridin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-aminocarbonyl-4-(3-dodecoxyphenyl)carbonyl-4H-pyridin-1-yl]ethanoate Openeye Name: ethyl 2-[3-carbamoyl-4-(3-dodecoxybenzoyl)-4H-pyridin-1-yl]acetate CAS Name: 2-[3-carbamoyl-4-[(3-dodecoxyphenyl)-oxomethyl]-4H-pyridin-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-carbamoyl-4-(3-dodecoxybenzoyl)-4H-pyridin-1-yl]acetate Traditional Name: 2-[3-carbamoyl-4-(3-lauryloxybenzoyl)-4H-pyridin-1-yl]acetic acid ethyl ester Formula: C29H42N2O5 MolecularWeight: 498.65418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=CC(=C1)C(=O)C2C=CN(C=C2C(=O)N)CC(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=CC(=C1)C(=O)C2C=CN(C=C2C(=O)N)CC(=O)OCC

InChI

InChI=1S/C29H42N2O5/c1-3-5-6-7-8-9-10-11-12-13-19-36-24-16-14-15-23(20-24)28(33)25-17-18-31(21-26(25)29(30)34)22-27(32)35-4-2/h14-18,20-21,25H,3-13,19,22H2,1-2H3,(H2,30,34)