4-[[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 4-[[allyl-[(5-chloro-2-thienyl)methyl]amino]methyl]-7-hydroxy-chromen-2-one CAS Name: 4-[[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]methyl]-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]methyl]-7-hydroxychromen-2-one Traditional Name: 4-[[allyl-[(5-chloro-2-thienyl)methyl]amino]methyl]-7-hydroxy-coumarin Formula: C18H16ClNO3S MolecularWeight: 361.84254

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(S1)Cl)CC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

C=CCN(CC1=CC=C(S1)Cl)CC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C18H16ClNO3S/c1-2-7-20(11-14-4-6-17(19)24-14)10-12-8-18(22)23-16-9-13(21)3-5-15(12)16/h2-6,8-9,21H,1,7,10-11H2