3-[3-(aminomethyl)pentan-3-yl]-8-chloranyl-4-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 3-[3-(aminomethyl)pentan-3-yl]-8-chloranyl-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: 3-[1-(aminomethyl)-1-ethyl-propyl]-8-chloro-7-hydroxy-4-methyl-chromen-2-one CAS Name: 3-[3-(aminomethyl)pentan-3-yl]-8-chloro-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 3-[3-(aminomethyl)pentan-3-yl]-8-chloro-7-hydroxy-4-methylchromen-2-one Traditional Name: 3-[1-(aminomethyl)-1-ethyl-propyl]-8-chloro-7-hydroxy-4-methyl-coumarin Formula: C16H20ClNO3 MolecularWeight: 309.7879

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CN)C1=C(C2=C(C(=C(C=C2)O)Cl)OC1=O)C

Isomeric SMILES

CCC(CC)(CN)C1=C(C2=C(C(=C(C=C2)O)Cl)OC1=O)C

InChI

InChI=1S/C16H20ClNO3/c1-4-16(5-2,8-18)12-9(3)10-6-7-11(19)13(17)14(10)21-15(12)20/h6-7,19H,4-5,8,18H2,1-3H3