2-[8-[3-(pyridin-2-ylamino)propoxy]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanoic acid

Systemtic Name: 2-[8-[3-(pyridin-2-ylamino)propoxy]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanoic acid Openeye Name: 2-[8-[3-(2-pyridylamino)propoxy]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetic acid CAS Name: 2-[8-[3-(2-pyridinylamino)propoxy]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetic acid IUPAC Name: 2-[8-[3-(pyridin-2-ylamino)propoxy]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetic acid Traditional Name: 2-[8-[3-(2-pyridylamino)propoxy]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetic acid Formula: C19H23N3O4 MolecularWeight: 357.40362

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1CC(=O)O)C=CC(=C2)OCCCNC3=CC=CC=N3

Isomeric SMILES

C1COC2=C(CN1CC(=O)O)C=CC(=C2)OCCCNC3=CC=CC=N3

InChI

InChI=1S/C19H23N3O4/c23-19(24)14-22-9-11-26-17-12-16(6-5-15(17)13-22)25-10-3-8-21-18-4-1-2-7-20-18/h1-2,4-7,12H,3,8-11,13-14H2,(H,20,21)(H,23,24)