4-[[[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]amino]methyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]amino]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[4-(4-ethylpiperazin-1-yl)-3-methyl-anilino]methyl]-7-methoxy-chromen-2-one CAS Name: 4-[[4-(4-ethyl-1-piperazinyl)-3-methylanilino]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[4-(4-ethylpiperazin-1-yl)-3-methylanilino]methyl]-7-methoxychromen-2-one Traditional Name: 4-[[4-(4-ethylpiperazino)-3-methyl-anilino]methyl]-7-methoxy-coumarin Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NCC3=CC(=O)OC4=C3C=CC(=C4)OC)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NCC3=CC(=O)OC4=C3C=CC(=C4)OC)C

InChI

InChI=1S/C24H29N3O3/c1-4-26-9-11-27(12-10-26)22-8-5-19(13-17(22)2)25-16-18-14-24(28)30-23-15-20(29-3)6-7-21(18)23/h5-8,13-15,25H,4,9-12,16H2,1-3H3