6-chloranyl-3-[1-(5-ethoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)piperidin-4-yl]-1,2-benzoxazole

Systemtic Name: 6-chloranyl-3-[1-(5-ethoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)piperidin-4-yl]-1,2-benzoxazole Openeye Name: 6-chloro-3-[1-(5-ethoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)-4-piperidyl]-1,2-benzoxazole CAS Name: 6-chloro-3-[1-(5-ethoxy-6-methoxy-1-cyclohexa-1,5-dienyl)-4-piperidinyl]-1,2-benzoxazole IUPAC Name: 6-chloro-3-[1-(5-ethoxy-6-methoxycyclohexa-1,5-dien-1-yl)piperidin-4-yl]-1,2-benzoxazole Traditional Name: 6-chloro-3-[1-(5-ethoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)-4-piperidyl]indoxazene Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CCC1)N2CCC(CC2)C3=NOC4=C3C=CC(=C4)Cl)OC

Isomeric SMILES

CCOC1=C(C(=CCC1)N2CCC(CC2)C3=NOC4=C3C=CC(=C4)Cl)OC

InChI

InChI=1S/C21H25ClN2O3/c1-3-26-18-6-4-5-17(21(18)25-2)24-11-9-14(10-12-24)20-16-8-7-15(22)13-19(16)27-23-20/h5,7-8,13-14H,3-4,6,9-12H2,1-2H3