3-(3-chloranyl-4-phenyl-phenyl)-4-[4-[3-(pyridin-2-ylamino)propoxy]phenyl]butanoate

Systemtic Name: 3-(3-chloranyl-4-phenyl-phenyl)-4-[4-[3-(pyridin-2-ylamino)propoxy]phenyl]butanoate Openeye Name: 3-(3-chloro-4-phenyl-phenyl)-4-[4-[3-(2-pyridylamino)propoxy]phenyl]butanoate CAS Name: 3-(3-chloro-4-phenylphenyl)-4-[4-[3-(2-pyridinylamino)propoxy]phenyl]butanoate IUPAC Name: 3-(3-chloro-4-phenylphenyl)-4-[4-[3-(pyridin-2-ylamino)propoxy]phenyl]butanoate Traditional Name: 3-(3-chloro-4-phenyl-phenyl)-4-[4-[3-(2-pyridylamino)propoxy]phenyl]butyrate Formula: C30H28ClN2O3- MolecularWeight: 500.00792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2)C(CC3=CC=C(C=C3)OCCCNC4=CC=CC=N4)CC(=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)C(CC3=CC=C(C=C3)OCCCNC4=CC=CC=N4)CC(=O)[O-])Cl

InChI

InChI=1S/C30H29ClN2O3/c31-28-20-24(12-15-27(28)23-7-2-1-3-8-23)25(21-30(34)35)19-22-10-13-26(14-11-22)36-18-6-17-33-29-9-4-5-16-32-29/h1-5,7-16,20,25H,6,17-19,21H2,(H,32,33)(H,34,35)/p-1