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

Systemtic Name: N-(2-azanylethyl)-2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]benzamide Openeye Name: N-(2-aminoethyl)-2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]benzamide CAS Name: N-(2-aminoethyl)-2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-9-xanthenyl]benzamide IUPAC Name: N-(2-aminoethyl)-2-[3-(ethylamino)-6-ethylimino-2,7-dimethylxanthen-9-yl]benzamide Traditional Name: N-(2-aminoethyl)-2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]benzamide Formula: C28H32N4O2 MolecularWeight: 456.57928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H32N4O2/c1-5-30-23-15-25-21(13-17(23)3)27(19-9-7-8-10-20(19)28(33)32-12-11-29)22-14-18(4)24(31-6-2)16-26(22)34-25/h7-10,13-16,30H,5-6,11-12,29H2,1-4H3,(H,32,33)