2-chloranyl-3-[[4-(hexylamino)phenyl]amino]-4a,8a-dihydronaphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[[4-(hexylamino)phenyl]amino]-4a,8a-dihydronaphthalene-1,4-dione Openeye Name: 2-chloro-3-[4-(hexylamino)anilino]-4a,8a-dihydronaphthalene-1,4-dione CAS Name: 2-chloro-3-[4-(hexylamino)anilino]-4a,8a-dihydronaphthalene-1,4-dione IUPAC Name: 2-chloro-3-[4-(hexylamino)anilino]-4a,8a-dihydronaphthalene-1,4-dione Traditional Name: 2-chloro-3-[4-(hexylamino)anilino]-4a,8a-dihydronaphthalene-1,4-quinone Formula: C22H25ClN2O2 MolecularWeight: 384.8991

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=CC=C(C=C1)NC2=C(C(=O)C3C=CC=CC3C2=O)Cl

Isomeric SMILES

CCCCCCNC1=CC=C(C=C1)NC2=C(C(=O)C3C=CC=CC3C2=O)Cl

InChI

InChI=1S/C22H25ClN2O2/c1-2-3-4-7-14-24-15-10-12-16(13-11-15)25-20-19(23)21(26)17-8-5-6-9-18(17)22(20)27/h5-6,8-13,17-18,24-25H,2-4,7,14H2,1H3