1-[1-(aminomethyl)-3,6-dimethoxy-9,9-dimethyl-xanthen-2-yl]-2-azanyl-3-methyl-butan-1-one

Systemtic Name: 1-[1-(aminomethyl)-3,6-dimethoxy-9,9-dimethyl-xanthen-2-yl]-2-azanyl-3-methyl-butan-1-one Openeye Name: 2-amino-1-[1-(aminomethyl)-3,6-dimethoxy-9,9-dimethyl-xanthen-2-yl]-3-methyl-butan-1-one CAS Name: 2-amino-1-[1-(aminomethyl)-3,6-dimethoxy-9,9-dimethyl-2-xanthenyl]-3-methyl-1-butanone IUPAC Name: 2-amino-1-[1-(aminomethyl)-3,6-dimethoxy-9,9-dimethylxanthen-2-yl]-3-methylbutan-1-one Traditional Name: 2-amino-1-[1-(aminomethyl)-3,6-dimethoxy-9,9-dimethyl-xanthen-2-yl]-3-methyl-butan-1-one Formula: C23H30N2O4 MolecularWeight: 398.4953

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C1=C(C=C2C(=C1CN)C(C3=C(O2)C=C(C=C3)OC)(C)C)OC)N

Isomeric SMILES

CC(C)C(C(=O)C1=C(C=C2C(=C1CN)C(C3=C(O2)C=C(C=C3)OC)(C)C)OC)N

InChI

InChI=1S/C23H30N2O4/c1-12(2)21(25)22(26)19-14(11-24)20-18(10-17(19)28-6)29-16-9-13(27-5)7-8-15(16)23(20,3)4/h7-10,12,21H,11,24-25H2,1-6H3