N-[(2S)-2-(4-tert-butylphenyl)-2-(dimethylamino)ethyl]-6-chloranyl-7-methyl-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: N-[(2S)-2-(4-tert-butylphenyl)-2-(dimethylamino)ethyl]-6-chloranyl-7-methyl-4-oxidanylidene-chromene-2-carboxamide Openeye Name: N-[(2S)-2-(4-tert-butylphenyl)-2-(dimethylamino)ethyl]-6-chloro-7-methyl-4-oxo-chromene-2-carboxamide CAS Name: N-[(2S)-2-(4-tert-butylphenyl)-2-(dimethylamino)ethyl]-6-chloro-7-methyl-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: N-[(2S)-2-(4-tert-butylphenyl)-2-(dimethylamino)ethyl]-6-chloro-7-methyl-4-oxochromene-2-carboxamide Traditional Name: N-[(2S)-2-(4-tert-butylphenyl)-2-(dimethylamino)ethyl]-6-chloro-4-keto-7-methyl-chromene-2-carboxamide Formula: C25H29ClN2O3 MolecularWeight: 440.96236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=CC2=O)C(=O)NCC(C3=CC=C(C=C3)C(C)(C)C)N(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=CC2=O)C(=O)NC[C@H](C3=CC=C(C=C3)C(C)(C)C)N(C)C)Cl

InChI

InChI=1S/C25H29ClN2O3/c1-15-11-22-18(12-19(15)26)21(29)13-23(31-22)24(30)27-14-20(28(5)6)16-7-9-17(10-8-16)25(2,3)4/h7-13,20H,14H2,1-6H3,(H,27,30)/t20-/m1/s1