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6-[(4-azanyl-4-methyl-1-adamantyl)oxy]-7-chloranyl-8aH-isoquinolin-1-one

Systemtic Name:	6-[(4-azanyl-4-methyl-1-adamantyl)oxy]-7-chloranyl-8aH-isoquinolin-1-one
Openeye Name:	6-[(4-amino-4-methyl-1-adamantyl)oxy]-7-chloro-8aH-isoquinolin-1-one
CAS Name:	6-[(4-amino-4-methyl-1-adamantyl)oxy]-7-chloro-8aH-isoquinolin-1-one
IUPAC Name:	6-[(4-amino-4-methyl-1-adamantyl)oxy]-7-chloro-8aH-isoquinolin-1-one
Traditional Name:	6-[(4-amino-4-methyl-1-adamantyl)oxy]-7-chloro-8aH-isoquinolin-1-one
Formula:	C₂₀H₂₃ClN₂O₂
MolecularWeight:	358.86182

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC3CC1CC(C3)(C2)OC4=CC5=CC=NC(=O)C5C=C4Cl)N

Isomeric SMILES

CC1(C2CC3CC1CC(C3)(C2)OC4=CC5=CC=NC(=O)C5C=C4Cl)N

InChI

InChI=1S/C20H23ClN2O2/c1-19(22)13-4-11-5-14(19)10-20(8-11,9-13)25-17-6-12-2-3-23-18(24)15(12)7-16(17)21/h2-3,6-7,11,13-15H,4-5,8-10,22H2,1H3

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