2-dimethylaminoethyl 2-[3-[(4-azanyl-7-methyl-3-oxidanylidene-6-propyl-1H-2-benzofuran-5-yl)methyl]-2-hexyl-cyclopent-2-en-1-yl]ethanoate

Systemtic Name: 2-dimethylaminoethyl 2-[3-[(4-azanyl-7-methyl-3-oxidanylidene-6-propyl-1H-2-benzofuran-5-yl)methyl]-2-hexyl-cyclopent-2-en-1-yl]ethanoate Openeye Name: 2-dimethylaminoethyl 2-[3-[(4-amino-7-methyl-3-oxo-6-propyl-1H-isobenzofuran-5-yl)methyl]-2-hexyl-cyclopent-2-en-1-yl]acetate CAS Name: 2-[3-[(4-amino-7-methyl-3-oxo-6-propyl-1H-isobenzofuran-5-yl)methyl]-2-hexyl-1-cyclopent-2-enyl]acetic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 2-[3-[(4-amino-7-methyl-3-oxo-6-propyl-1H-2-benzofuran-5-yl)methyl]-2-hexylcyclopent-2-en-1-yl]acetate Traditional Name: 2-[3-[(4-amino-3-keto-7-methyl-6-propyl-phthalan-5-yl)methyl]-2-hexyl-cyclopent-2-en-1-yl]acetic acid 2-dimethylaminoethyl ester Formula: C30H46N2O4 MolecularWeight: 498.69724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(CCC1CC(=O)OCCN(C)C)CC2=C(C3=C(COC3=O)C(=C2CCC)C)N

Isomeric SMILES

CCCCCCC1=C(CCC1CC(=O)OCCN(C)C)CC2=C(C3=C(COC3=O)C(=C2CCC)C)N

InChI

InChI=1S/C30H46N2O4/c1-6-8-9-10-12-24-21(13-14-22(24)18-27(33)35-16-15-32(4)5)17-25-23(11-7-2)20(3)26-19-36-30(34)28(26)29(25)31/h22H,6-19,31H2,1-5H3