azane; 1-chloranyl-7-methoxy-4-pyridin-4-yl-2,3-dihydro-1H-isoindole

Systemtic Name: azane; 1-chloranyl-7-methoxy-4-pyridin-4-yl-2,3-dihydro-1H-isoindole Openeye Name: ammonia; 1-chloro-7-methoxy-4-(4-pyridyl)isoindoline CAS Name: ammonia; 1-chloro-7-methoxy-4-pyridin-4-yl-2,3-dihydro-1H-isoindole IUPAC Name: azane; 1-chloro-7-methoxy-4-pyridin-4-yl-2,3-dihydro-1H-isoindole Traditional Name: ammonia; 1-chloro-7-methoxy-4-(4-pyridyl)isoindoline Formula: C14H16ClN3O MolecularWeight: 277.74934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(NCC2=C(C=C1)C3=CC=NC=C3)Cl.N

Isomeric SMILES

COC1=C2C(NCC2=C(C=C1)C3=CC=NC=C3)Cl.N

InChI

InChI=1S/C14H13ClN2O.H3N/c1-18-12-3-2-10(9-4-6-16-7-5-9)11-8-17-14(15)13(11)12;/h2-7,14,17H,8H2,1H3;1H3