N-(6-azanylhexyl)-2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]benzamide

Systemtic Name: N-(6-azanylhexyl)-2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]benzamide Openeye Name: N-(6-aminohexyl)-2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]benzamide CAS Name: N-(6-aminohexyl)-2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-9-xanthenyl]benzamide IUPAC Name: N-(6-aminohexyl)-2-[3-(ethylamino)-6-ethylimino-2,7-dimethylxanthen-9-yl]benzamide Traditional Name: N-(6-aminohexyl)-2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]benzamide Formula: C32H40N4O2 MolecularWeight: 512.6856

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)OC3=CC(=NCC)C(=CC3=C2C4=CC=CC=C4C(=O)NCCCCCCN)C)C

Isomeric SMILES

CCNC1=C(C=C2C(=C1)OC3=CC(=NCC)C(=CC3=C2C4=CC=CC=C4C(=O)NCCCCCCN)C)C

InChI

InChI=1S/C32H40N4O2/c1-5-34-27-19-29-25(17-21(27)3)31(26-18-22(4)28(35-6-2)20-30(26)38-29)23-13-9-10-14-24(23)32(37)36-16-12-8-7-11-15-33/h9-10,13-14,17-20,34H,5-8,11-12,15-16,33H2,1-4H3,(H,36,37)