3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]propanamide

Systemtic Name: 3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]propanamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)propanamide CAS Name: 3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]propanamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)propionamide Formula: C25H29N2O4+ MolecularWeight: 421.50876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)NC3CC[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)N[C@H]3CC[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N2O4/c1-17-21-9-8-20(30-2)14-23(21)31-25(29)22(17)10-11-24(28)26-19-12-13-27(16-19)15-18-6-4-3-5-7-18/h3-9,14,19H,10-13,15-16H2,1-2H3,(H,26,28)/p+1/t19-/m0/s1