3-azanyl-7-[2,6-bis(azanyl)hexanoyl]-4-methyl-chromen-2-one

Systemtic Name: 3-azanyl-7-[2,6-bis(azanyl)hexanoyl]-4-methyl-chromen-2-one Openeye Name: 3-amino-7-(2,6-diaminohexanoyl)-4-methyl-chromen-2-one CAS Name: 3-amino-7-(2,6-diamino-1-oxohexyl)-4-methyl-1-benzopyran-2-one IUPAC Name: 3-amino-7-(2,6-diaminohexanoyl)-4-methylchromen-2-one Traditional Name: 3-amino-7-(2,6-diaminohexanoyl)-4-methyl-coumarin Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)C(=O)C(CCCCN)N)N

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)C(=O)C(CCCCN)N)N

InChI

InChI=1S/C16H21N3O3/c1-9-11-6-5-10(8-13(11)22-16(21)14(9)19)15(20)12(18)4-2-3-7-17/h5-6,8,12H,2-4,7,17-19H2,1H3